CAS RN: 876717-12-3
CAS Name: 4-(aminomethyl)-N,N,1-trimethyl-4-piperidinamine
OPENEYE Name: 4-(aminomethyl)-N,N,1-trimethyl-piperidin-4-amine
IUPAC Name: 4-(aminomethyl)-N,N,1-trimethylpiperidin-4-amine
SYSTEMATIC NAME: 4-(aminomethyl)-N,N,1-trimethyl-piperidin-4-amine
MOLECULAR FORMULA: C9H21N3
MOLECULAR WEIGHT: 171.28314
SMILES: CN1CCC(CC1)(CN)N(C)C
Structure:
CAS RN: 869942-76-7
CAS Name: 3-chloro-4-(1-imidazolyl)aniline
OPENEYE Name: 3-chloro-4-imidazol-1-yl-aniline
IUPAC Name: 3-chloro-4-imidazol-1-ylaniline
SYSTEMATIC NAME: 3-chloranyl-4-imidazol-1-yl-aniline
MOLECULAR FORMULA: C9H8ClN3
MOLECULAR WEIGHT: 193.63292
SMILES: C1=CC(=C(C=C1N)Cl)N2C=CN=C2
Structure:
CAS RN: 280771-97-3
CAS Name: 1-propan-2-yl-4-piperidinecarboxylic acid
OPENEYE Name: 1-isopropylpiperidine-4-carboxylic acid
IUPAC Name: 1-propan-2-ylpiperidine-4-carboxylic acid
SYSTEMATIC NAME: 1-propan-2-ylpiperidine-4-carboxylic acid
MOLECULAR FORMULA: C9H17NO2
MOLECULAR WEIGHT: 171.23678
SMILES: CC(C)N1CCC(CC1)C(=O)O
Structure:
CAS RN: 91271-83-9
CAS Name: [3-(4-morpholinylmethyl)phenyl]methanamine
OPENEYE Name: [3-(morpholinomethyl)phenyl]methanamine
IUPAC Name: [3-(morpholin-4-ylmethyl)phenyl]methanamine
SYSTEMATIC NAME: [3-(morpholin-4-ylmethyl)phenyl]methanamine
MOLECULAR FORMULA: C12H18N2O
MOLECULAR WEIGHT: 206.28412
SMILES: C1COCCN1CC2=CC(=CC=C2)CN
Structure:
CAS RN: 876716-58-4
CAS Name: 2-(3,5-dimethyl-1-piperidinyl)ethanamine
OPENEYE Name: 2-(3,5-dimethyl-1-piperidyl)ethanamine
IUPAC Name: 2-(3,5-dimethylpiperidin-1-yl)ethanamine
SYSTEMATIC NAME: 2-(3,5-dimethylpiperidin-1-yl)ethanamine
MOLECULAR FORMULA: C9H20N2
MOLECULAR WEIGHT: 156.2685
SMILES: CC1CC(CN(C1)CCN)C
Structure:
CAS RN: 876716-32-4
CAS Name: 2-(5-methyl-1-tetrazolyl)-2-phenylacetic acid
OPENEYE Name: 2-(5-methyltetrazol-1-yl)-2-phenyl-acetic acid
IUPAC Name: 2-(5-methyltetrazol-1-yl)-2-phenylacetic acid
SYSTEMATIC NAME: 2-(5-methyl-1,2,3,4-tetrazol-1-yl)-2-phenyl-ethanoic acid
MOLECULAR FORMULA: C10H10N4O2
MOLECULAR WEIGHT: 218.212
SMILES: CC1=NN=NN1C(C2=CC=CC=C2)C(=O)O
Structure:
CAS RN: 74247-30-6
CAS Name: 4-(1-piperidinyl)-1-butanamine
OPENEYE Name: 4-(1-piperidyl)butan-1-amine
IUPAC Name: 4-piperidin-1-ylbutan-1-amine
SYSTEMATIC NAME: 4-piperidin-1-ylbutan-1-amine
MOLECULAR FORMULA: C9H20N2
MOLECULAR WEIGHT: 156.2685
SMILES: C1CCN(CC1)CCCCN
Structure:
CAS RN: 876715-98-9
CAS Name: 4-methyl-2-(phenylmethyl)-5-thiazolecarboxylic acid
OPENEYE Name: 2-benzyl-4-methyl-thiazole-5-carboxylic acid
IUPAC Name: 2-benzyl-4-methyl-1,3-thiazole-5-carboxylic acid
SYSTEMATIC NAME: 4-methyl-2-(phenylmethyl)-1,3-thiazole-5-carboxylic acid
MOLECULAR FORMULA: C12H11NO2S
MOLECULAR WEIGHT: 233.28624
SMILES: CC1=C(SC(=N1)CC2=CC=CC=C2)C(=O)O
Structure:
CAS RN: 875160-04-6
CAS Name: 2-(5-methyl-2-furanyl)-2-(4-morpholinyl)ethanamine
OPENEYE Name: 2-(5-methyl-2-furyl)-2-morpholino-ethanamine
IUPAC Name: 2-(5-methylfuran-2-yl)-2-morpholin-4-ylethanamine
SYSTEMATIC NAME: 2-(5-methylfuran-2-yl)-2-morpholin-4-yl-ethanamine
MOLECULAR FORMULA: C11H18N2O2
MOLECULAR WEIGHT: 210.27282
SMILES: CC1=CC=C(O1)C(CN)N2CCOCC2
Structure:
CAS RN: 179873-36-0
CAS Name: N-methyl-1-(6-quinolinyl)methanamine
OPENEYE Name: N-methyl-1-(6-quinolyl)methanamine
IUPAC Name: N-methyl-1-quinolin-6-ylmethanamine
SYSTEMATIC NAME: N-methyl-1-quinolin-6-yl-methanamine
MOLECULAR FORMULA: C11H12N2
MOLECULAR WEIGHT: 172.22638
SMILES: CNCC1=CC2=C(C=C1)N=CC=C2
Structure:
CAS RN: 1689-02-7
CAS Name: 1-pyrrolidinesulfonyl chloride
OPENEYE Name: pyrrolidine-1-sulfonyl chloride
IUPAC Name: pyrrolidine-1-sulfonyl chloride
SYSTEMATIC NAME: pyrrolidine-1-sulfonyl chloride
MOLECULAR FORMULA: C4H8ClNO2S
MOLECULAR WEIGHT: 169.62982
SMILES: C1CCN(C1)S(=O)(=O)Cl
Structure:
CAS RN: 543713-30-0
CAS Name: (3-propan-2-yl-5-isoxazolyl)methanamine
OPENEYE Name: (3-isopropylisoxazol-5-yl)methanamine
IUPAC Name: (3-propan-2-yl-1,2-oxazol-5-yl)methanamine
SYSTEMATIC NAME: (3-propan-2-yl-1,2-oxazol-5-yl)methanamine
MOLECULAR FORMULA: C7H12N2O
MOLECULAR WEIGHT: 140.18298
SMILES: CC(C)C1=NOC(=C1)CN
Structure:
CAS RN: 145689-96-9
CAS Name: (3-ethyl-5-isoxazolyl)methanamine
OPENEYE Name: (3-ethylisoxazol-5-yl)methanamine
IUPAC Name: (3-ethyl-1,2-oxazol-5-yl)methanamine
SYSTEMATIC NAME: (3-ethyl-1,2-oxazol-5-yl)methanamine
MOLECULAR FORMULA: C6H10N2O
MOLECULAR WEIGHT: 126.1564
SMILES: CCC1=NOC(=C1)CN
Structure:
CAS RN: 936940-34-0
CAS Name: 1-(3,5-dimethyl-1-pyrazolyl)-2-propanamine
OPENEYE Name: 1-(3,5-dimethylpyrazol-1-yl)propan-2-amine
IUPAC Name: 1-(3,5-dimethylpyrazol-1-yl)propan-2-amine
SYSTEMATIC NAME: 1-(3,5-dimethylpyrazol-1-yl)propan-2-amine
MOLECULAR FORMULA: C8H15N3
MOLECULAR WEIGHT: 153.2248
SMILES: CC1=CC(=NN1CC(C)N)C
Structure:
CAS RN: 63874-99-7
CAS Name: 1-(4-chlorophenyl)-4-pyrazolecarboxaldehyde
OPENEYE Name: 1-(4-chlorophenyl)pyrazole-4-carbaldehyde
IUPAC Name: 1-(4-chlorophenyl)pyrazole-4-carbaldehyde
SYSTEMATIC NAME: 1-(4-chlorophenyl)pyrazole-4-carbaldehyde
MOLECULAR FORMULA: C10H7ClN2O
MOLECULAR WEIGHT: 206.62838
SMILES: C1=CC(=CC=C1N2C=C(C=N2)C=O)Cl
Structure:
CAS RN: 911788-36-8
CAS Name: 1-(1,3-dimethyl-4-pyrazolyl)ethanamine
OPENEYE Name: 1-(1,3-dimethylpyrazol-4-yl)ethanamine
IUPAC Name: 1-(1,3-dimethylpyrazol-4-yl)ethanamine
SYSTEMATIC NAME: 1-(1,3-dimethylpyrazol-4-yl)ethanamine
MOLECULAR FORMULA: C7H13N3
MOLECULAR WEIGHT: 139.19822
SMILES: CC1=NN(C=C1C(C)N)C
Structure:
CAS RN: 401647-24-3
CAS Name: 1-(phenylmethyl)-4-pyrazolecarboxylic acid
OPENEYE Name: 1-benzylpyrazole-4-carboxylic acid
IUPAC Name: 1-benzylpyrazole-4-carboxylic acid
SYSTEMATIC NAME: 1-(phenylmethyl)pyrazole-4-carboxylic acid
MOLECULAR FORMULA: C11H10N2O2
MOLECULAR WEIGHT: 202.2093
SMILES: C1=CC=C(C=C1)CN2C=C(C=N2)C(=O)O
Structure:
CAS RN: 126417-81-0
CAS Name: 5-(4-fluorophenyl)-2-methyl-3-pyrazolamine
OPENEYE Name: 5-(4-fluorophenyl)-2-methyl-pyrazol-3-amine
IUPAC Name: 5-(4-fluorophenyl)-2-methylpyrazol-3-amine
SYSTEMATIC NAME: 5-(4-fluorophenyl)-2-methyl-pyrazol-3-amine
MOLECULAR FORMULA: C10H10FN3
MOLECULAR WEIGHT: 191.204903
SMILES: CN1C(=CC(=N1)C2=CC=C(C=C2)F)N
Structure:
CAS RN: 89776-74-9
CAS Name: 5-propan-2-yl-3-isoxazolecarboxylic acid
OPENEYE Name: 5-isopropylisoxazole-3-carboxylic acid
IUPAC Name: 5-propan-2-yl-1,2-oxazole-3-carboxylic acid
SYSTEMATIC NAME: 5-propan-2-yl-1,2-oxazole-3-carboxylic acid
MOLECULAR FORMULA: C7H9NO3
MOLECULAR WEIGHT: 155.15126
SMILES: CC(C)C1=CC(=NO1)C(=O)O
Structure:
CAS RN: 52320-59-9
CAS Name: 5-ethyl-3-isoxazolecarboxylic acid
OPENEYE Name: 5-ethylisoxazole-3-carboxylic acid
IUPAC Name: 5-ethyl-1,2-oxazole-3-carboxylic acid
SYSTEMATIC NAME: 5-ethyl-1,2-oxazole-3-carboxylic acid
MOLECULAR FORMULA: C6H7NO3
MOLECULAR WEIGHT: 141.12468
SMILES: CCC1=CC(=NO1)C(=O)O
Structure:
CAS RN: 158257-82-0
CAS Name: 3-(2-pyridinylmethoxy)benzaldehyde
OPENEYE Name: 3-(2-pyridylmethoxy)benzaldehyde
IUPAC Name: 3-(pyridin-2-ylmethoxy)benzaldehyde
SYSTEMATIC NAME: 3-(pyridin-2-ylmethoxy)benzaldehyde
MOLECULAR FORMULA: C13H11NO2
MOLECULAR WEIGHT: 213.23194
SMILES: C1=CC=NC(=C1)COC2=CC=CC(=C2)C=O
Structure:
CAS RN: 101488-65-7
CAS Name: 3-(4-fluorophenyl)-1-propanamine
OPENEYE Name: 3-(4-fluorophenyl)propan-1-amine
IUPAC Name: 3-(4-fluorophenyl)propan-1-amine
SYSTEMATIC NAME: 3-(4-fluorophenyl)propan-1-amine
MOLECULAR FORMULA: C9H12FN
MOLECULAR WEIGHT: 153.196683
SMILES: C1=CC(=CC=C1CCCN)F
Structure:
CAS RN: 222723-55-9
CAS Name: 2-[(5Z,8Z,11Z,14Z)-eicosa-5,8,11,14-tetraenoxy]propane-1,3-diol
OPENEYE Name: 2-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoxy]propane-1,3-diol
IUPAC Name: 2-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoxy]propane-1,3-diol
SYSTEMATIC NAME: 2-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoxy]propane-1,3-diol
MOLECULAR FORMULA: C23H40O3
MOLECULAR WEIGHT: 364.5619
SMILES: CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCOC(CO)CO
Structure:
CAS RN: 125995-03-1
CAS Name: 5-(4-fluorophenyl)-1-[2-[(2R,4R)-4-hydroxy-6-oxo-2-oxanyl]ethyl]-N,4-diphenyl-2-propan-2-yl-3-pyrrolecarboxamide
OPENEYE Name: 5-(4-fluorophenyl)-1-[2-[(2R,4R)-4-hydroxy-6-oxo-tetrahydropyran-2-yl]ethyl]-2-isopropyl-N,4-diphenyl-pyrrole-3-carboxamide
IUPAC Name: 5-(4-fluorophenyl)-1-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl]-N,4-diphenyl-2-propan-2-ylpyrrole-3-carboxamide
SYSTEMATIC NAME: 5-(4-fluorophenyl)-1-[2-[(2R,4R)-4-oxidanyl-6-oxidanylidene-oxan-2-yl]ethyl]-N,4-diphenyl-2-propan-2-yl-pyrrole-3-carboxamide
MOLECULAR FORMULA: C33H33FN2O4
MOLECULAR WEIGHT: 540.624523
SMILES: CC(C)C1=C(C(=C(N1CC[C@@H]2C[C@H](CC(=O)O2)O)C3=CC=C(C=C3)F)C4=CC=CC=C4)C(=O)NC5=CC=CC=C5
Structure:
CAS RN: 191282-48-1
CAS Name: (2S,3R)-4-methylene-2-octyl-5-oxo-3-oxolanecarboxylic acid
OPENEYE Name: (2S,3R)-4-methylene-2-octyl-5-oxo-tetrahydrofuran-3-carboxylic acid
IUPAC Name: (2S,3R)-4-methylidene-2-octyl-5-oxooxolane-3-carboxylic acid
SYSTEMATIC NAME: (2S,3R)-4-methylidene-2-octyl-5-oxidanylidene-oxolane-3-carboxylic acid
MOLECULAR FORMULA: C14H22O4
MOLECULAR WEIGHT: 254.32208
SMILES: CCCCCCCC[C@H]1[C@@H](C(=C)C(=O)O1)C(=O)O
Structure:
CAS RN: 67410-65-5
CAS Name: 2-amino-8-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-4-imidazo[1,2-a][1,3,5]triazinone
OPENEYE Name: 2-amino-8-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]imidazo[1,2-a][1,3,5]triazin-4-one
IUPAC Name: 2-amino-8-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]imidazo[1,2-a][1,3,5]triazin-4-one
SYSTEMATIC NAME: 2-azanyl-8-[(2R,3R,4S,5R)-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]imidazo[1,2-a][1,3,5]triazin-4-one
MOLECULAR FORMULA: C10H13N5O5
MOLECULAR WEIGHT: 283.24072
SMILES: C1=CN2C(=NC(=NC2=O)N)N1[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O
Structure:
CAS RN: 188127-65-3
CAS Name: (3S,5R,8S,9S,10R,13S,14S,17R)-3-bromo-17-[(2S,3S,4S,5S)-5-ethyl-3,4-dihydroxy-6-methylheptan-2-yl]-5-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-6-one
OPENEYE Name: (3S,5R,8S,9S,10R,13S,14S,17R)-3-bromo-17-[(1S,2S,3S,4S)-4-ethyl-2,3-dihydroxy-1,5-dimethyl-hexyl]-5-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-6-one
IUPAC Name: (3S,5R,8S,9S,10R,13S,14S,17R)-3-bromo-17-[(2S,3S,4S,5S)-5-ethyl-3,4-dihydroxy-6-methylheptan-2-yl]-5-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-6-one
SYSTEMATIC NAME: (3S,5R,8S,9S,10R,13S,14S,17R)-3-bromanyl-17-[(2S,3S,4S,5S)-5-ethyl-6-methyl-3,4-bis(oxidanyl)heptan-2-yl]-10,13-dimethyl-5-oxidanyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-6-one
MOLECULAR FORMULA: C29H49BrO4
MOLECULAR WEIGHT: 541.60096
SMILES: CC[C@H]([C@@H]([C@H]([C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC(=O)[C@@]4([C@@]3(CC[C@@H](C4)Br)C)O)C)O)O)C(C)C
Structure:
CAS RN: 6824-10-8
CAS Name: [(E)-7H-purin-6-ylmethylideneamino]thiourea
OPENEYE Name: [(E)-7H-purin-6-ylmethyleneamino]thiourea
IUPAC Name: [(E)-7H-purin-6-ylmethylideneamino]thiourea
SYSTEMATIC NAME: 1-[(E)-7H-purin-6-ylmethylideneamino]thiourea
MOLECULAR FORMULA: C7H7N7S
MOLECULAR WEIGHT: 221.24238
SMILES: C1=NC2=NC=NC(=C2N1)/C=N/NC(=S)N
Structure:
CAS RN: 62534-68-3
CAS Name: (4E,6E,8E,10Z,12Z,14E,16E)-3-[[(2R,3S,4S,5S,6R)-4-amino-3,5-dihydroxy-6-methyl-2-oxanyl]oxy]-23,27,29,31,33,35,37-heptahydroxy-19-[5-hydroxy-7-[4-(methylamino)phenyl]-7-oxoheptan-2-yl]-18-methyl-21,25-dioxo-20,39-dioxabicyclo[33.3.1]nonatriaconta-4,6,8,10
OPENEYE Name: methyl (4E,6E,8E,10Z,12Z,14E,16E)-3-[(2R,3S,4S,5S,6R)-4-amino-3,5-dihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-23,27,29,31,33,35,37-heptahydroxy-19-[4-hydroxy-1-methyl-6-[4-(methylamino)phenyl]-6-oxo-hexyl]-18-methyl-21,25-dioxo-20,39-dioxabicyclo[33.3.1]n
IUPAC Name: methyl (4E,6E,8E,10Z,12Z,14E,16E)-3-[(2R,3S,4S,5S,6R)-4-amino-3,5-dihydroxy-6-methyloxan-2-yl]oxy-23,27,29,31,33,35,37-heptahydroxy-19-[5-hydroxy-7-[4-(methylamino)phenyl]-7-oxoheptan-2-yl]-18-methyl-21,25-dioxo-20,39-dioxabicyclo[33.3.1]nonatriaconta-4,6
SYSTEMATIC NAME: methyl (4E,6E,8E,10Z,12Z,14E,16E)-3-[(2R,3S,4S,5S,6R)-4-azanyl-6-methyl-3,5-bis(oxidanyl)oxan-2-yl]oxy-18-methyl-19-[7-[4-(methylamino)phenyl]-5-oxidanyl-7-oxidanylidene-heptan-2-yl]-23,27,29,31,33,35,37-heptakis(oxidanyl)-21,25-bis(oxidanylidene)-20,39-d
MOLECULAR FORMULA: C60H88N2O19
MOLECULAR WEIGHT: 1141.34272
SMILES: C[C@@H]1[C@H]([C@@H]([C@@H]([C@@H](O1)OC\2CC3C(C(CC(O3)(CC(CC(CC(CC(CC(=O)CC(CC(=O)OC(C(/C=C/C=C/C=C\C=C/C=C/C=C/C=C2)C)C(C)CCC(CC(=O)C4=CC=C(C=C4)NC)O)O)O)O)O)O)O)O)C(=O)OC)O)N)O
Structure:
CAS RN: 137042-33-2
CAS Name: (4E,6E,8E,10Z,12Z,14E,16E)-3-[[(2R,3S,4S,5S,6R)-4-amino-3,5-dihydroxy-6-methyl-2-oxanyl]oxy]-23,27,29,31,33,35,37-heptahydroxy-19-[5-hydroxy-7-[4-(methylamino)phenyl]-7-oxoheptan-2-yl]-18-methyl-21,25-dioxo-N-[2-(2-pyridinyl)ethyl]-20,39-dioxabicyclo[33.3
OPENEYE Name: (4E,6E,8E,10Z,12Z,14E,16E)-3-[(2R,3S,4S,5S,6R)-4-amino-3,5-dihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-23,27,29,31,33,35,37-heptahydroxy-19-[4-hydroxy-1-methyl-6-[4-(methylamino)phenyl]-6-oxo-hexyl]-18-methyl-21,25-dioxo-N-[2-(2-pyridyl)ethyl]-20,39-dioxa
IUPAC Name: (4E,6E,8E,10Z,12Z,14E,16E)-3-[(2R,3S,4S,5S,6R)-4-amino-3,5-dihydroxy-6-methyloxan-2-yl]oxy-23,27,29,31,33,35,37-heptahydroxy-19-[5-hydroxy-7-[4-(methylamino)phenyl]-7-oxoheptan-2-yl]-18-methyl-21,25-dioxo-N-(2-pyridin-2-ylethyl)-20,39-dioxabicyclo[33.3.1]
SYSTEMATIC NAME: (4E,6E,8E,10Z,12Z,14E,16E)-3-[(2R,3S,4S,5S,6R)-4-azanyl-6-methyl-3,5-bis(oxidanyl)oxan-2-yl]oxy-18-methyl-19-[7-[4-(methylamino)phenyl]-5-oxidanyl-7-oxidanylidene-heptan-2-yl]-23,27,29,31,33,35,37-heptakis(oxidanyl)-21,25-bis(oxidanylidene)-N-(2-pyridin-2
MOLECULAR FORMULA: C66H94N4O18
MOLECULAR WEIGHT: 1231.46856
SMILES: C[C@@H]1[C@H]([C@@H]([C@@H]([C@@H](O1)OC\2CC3C(C(CC(O3)(CC(CC(CC(CC(CC(=O)CC(CC(=O)OC(C(/C=C/C=C/C=C\C=C/C=C/C=C/C=C2)C)C(C)CCC(CC(=O)C4=CC=C(C=C4)NC)O)O)O)O)O)O)O)O)C(=O)NCCC5=CC=CC=N5)O)N)O
Structure:
CAS RN: 137042-51-4
CAS Name: (4E,6E,8E,10Z,12Z,14E,16E)-3-[[(2R,3S,4S,5S,6R)-4-amino-3,5-dihydroxy-6-methyl-2-oxanyl]oxy]-23,27,29,31,33,35,37-heptahydroxy-19-[5-hydroxy-7-[4-(methylamino)phenyl]-7-oxoheptan-2-yl]-18-methyl-N-[2-(4-morpholinyl)ethyl]-21,25-dioxo-20,39-dioxabicyclo[33
OPENEYE Name: (4E,6E,8E,10Z,12Z,14E,16E)-3-[(2R,3S,4S,5S,6R)-4-amino-3,5-dihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-23,27,29,31,33,35,37-heptahydroxy-19-[4-hydroxy-1-methyl-6-[4-(methylamino)phenyl]-6-oxo-hexyl]-18-methyl-N-(2-morpholinoethyl)-21,25-dioxo-20,39-dioxab
IUPAC Name: (4E,6E,8E,10Z,12Z,14E,16E)-3-[(2R,3S,4S,5S,6R)-4-amino-3,5-dihydroxy-6-methyloxan-2-yl]oxy-23,27,29,31,33,35,37-heptahydroxy-19-[5-hydroxy-7-[4-(methylamino)phenyl]-7-oxoheptan-2-yl]-18-methyl-N-(2-morpholin-4-ylethyl)-21,25-dioxo-20,39-dioxabicyclo[33.3.
SYSTEMATIC NAME: (4E,6E,8E,10Z,12Z,14E,16E)-3-[(2R,3S,4S,5S,6R)-4-azanyl-6-methyl-3,5-bis(oxidanyl)oxan-2-yl]oxy-18-methyl-19-[7-[4-(methylamino)phenyl]-5-oxidanyl-7-oxidanylidene-heptan-2-yl]-N-(2-morpholin-4-ylethyl)-23,27,29,31,33,35,37-heptakis(oxidanyl)-21,25-bis(oxi
MOLECULAR FORMULA: C65H98N4O19
MOLECULAR WEIGHT: 1239.48902
SMILES: C[C@@H]1[C@H]([C@@H]([C@@H]([C@@H](O1)OC\2CC3C(C(CC(O3)(CC(CC(CC(CC(CC(=O)CC(CC(=O)OC(C(/C=C/C=C/C=C\C=C/C=C/C=C/C=C2)C)C(C)CCC(CC(=O)C4=CC=C(C=C4)NC)O)O)O)O)O)O)O)O)C(=O)NCCN5CCOCC5)O)N)O
Structure:
CAS RN: 5956-97-8
CAS Name: N-[(E)-[2-oxo-2-[4-(phenylthio)phenyl]ethylidene]amino]-2-(1-pyrrolidinyl)acetamide
OPENEYE Name: N-[(E)-[2-oxo-2-(4-phenylsulfanylphenyl)ethylidene]amino]-2-pyrrolidin-1-yl-acetamide
IUPAC Name: N-[(E)-[2-oxo-2-(4-phenylsulfanylphenyl)ethylidene]amino]-2-pyrrolidin-1-ylacetamide
SYSTEMATIC NAME: N-[(E)-[2-oxidanylidene-2-(4-phenylsulfanylphenyl)ethylidene]amino]-2-pyrrolidin-1-yl-ethanamide
MOLECULAR FORMULA: C20H21N3O2S
MOLECULAR WEIGHT: 367.46464
SMILES: C1CCN(C1)CC(=O)N/N=C/C(=O)C2=CC=C(C=C2)SC3=CC=CC=C3
Structure:
CAS RN: 7037-21-0
CAS Name: 2-(4-morpholinyl)-N-[(E)-[2-oxo-2-(4-phenylphenyl)ethylidene]amino]acetamide
OPENEYE Name: 2-morpholino-N-[(E)-[2-oxo-2-(4-phenylphenyl)ethylidene]amino]acetamide
IUPAC Name: 2-morpholin-4-yl-N-[(E)-[2-oxo-2-(4-phenylphenyl)ethylidene]amino]acetamide
SYSTEMATIC NAME: 2-morpholin-4-yl-N-[(E)-[2-oxidanylidene-2-(4-phenylphenyl)ethylidene]amino]ethanamide
MOLECULAR FORMULA: C20H21N3O3
MOLECULAR WEIGHT: 351.39904
SMILES: C1COCCN1CC(=O)N/N=C/C(=O)C2=CC=C(C=C2)C3=CC=CC=C3
Structure:
CAS RN: 5956-96-7
CAS Name: N-[(E)-[2-oxo-2-(4-phenylphenyl)ethylidene]amino]-2-(1-piperidinyl)acetamide
OPENEYE Name: N-[(E)-[2-oxo-2-(4-phenylphenyl)ethylidene]amino]-2-(1-piperidyl)acetamide
IUPAC Name: N-[(E)-[2-oxo-2-(4-phenylphenyl)ethylidene]amino]-2-piperidin-1-ylacetamide
SYSTEMATIC NAME: N-[(E)-[2-oxidanylidene-2-(4-phenylphenyl)ethylidene]amino]-2-piperidin-1-yl-ethanamide
MOLECULAR FORMULA: C21H23N3O2
MOLECULAR WEIGHT: 349.42622
SMILES: C1CCN(CC1)CC(=O)N/N=C/C(=O)C2=CC=C(C=C2)C3=CC=CC=C3
Structure:
CAS RN: 5956-93-4
CAS Name: N-[(E)-[2-oxo-2-(4-phenylphenyl)ethylidene]amino]-2-(1-pyrrolidinyl)acetamide
OPENEYE Name: N-[(E)-[2-oxo-2-(4-phenylphenyl)ethylidene]amino]-2-pyrrolidin-1-yl-acetamide
IUPAC Name: N-[(E)-[2-oxo-2-(4-phenylphenyl)ethylidene]amino]-2-pyrrolidin-1-ylacetamide
SYSTEMATIC NAME: N-[(E)-[2-oxidanylidene-2-(4-phenylphenyl)ethylidene]amino]-2-pyrrolidin-1-yl-ethanamide
MOLECULAR FORMULA: C20H21N3O2
MOLECULAR WEIGHT: 335.39964
SMILES: C1CCN(C1)CC(=O)N/N=C/C(=O)C2=CC=C(C=C2)C3=CC=CC=C3
Structure:
No comments:
Post a Comment