CAS RN: 7469-20-7
CAS Name: N-[2-[(1-amino-1-oxopropan-2-yl)amino]-2-oxoethyl]carbamic acid prop-2-enyl ester
OPENEYE Name: allyl N-[2-[(2-amino-1-methyl-2-oxo-ethyl)amino]-2-oxo-ethyl]carbamate
IUPAC Name: prop-2-enyl N-[2-[(1-amino-1-oxopropan-2-yl)amino]-2-oxoethyl]carbamate
SYSTEMATIC NAME: prop-2-enyl N-[2-[(1-azanyl-1-oxidanylidene-propan-2-yl)amino]-2-oxidanylidene-ethyl]carbamate
MOLECULAR FORMULA: C9H15N3O4
MOLECULAR WEIGHT: 229.2331
SMILES: CC(C(=O)N)NC(=O)CNC(=O)OCC=C
Structure:
CAS RN: 14723-86-5
CAS Name: 2-amino-N'-phenylacetohydrazide
OPENEYE Name: 2-amino-N'-phenyl-acetohydrazide
IUPAC Name: 2-amino-N'-phenylacetohydrazide
SYSTEMATIC NAME: 2-azanyl-N'-phenyl-ethanehydrazide
MOLECULAR FORMULA: C8H11N3O
MOLECULAR WEIGHT: 165.19244
SMILES: C1=CC=C(C=C1)NNC(=O)CN
Structure:
CAS RN: 7469-16-1
CAS Name: acetic acid [10,13-dimethyl-17-(2-methyl-1,3-dioxolan-2-yl)-2,3,4,5,6,7,8,9,11,12,14,15-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] ester
OPENEYE Name: [10,13-dimethyl-17-(2-methyl-1,3-dioxolan-2-yl)-2,3,4,5,6,7,8,9,11,12,14,15-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate
IUPAC Name: [10,13-dimethyl-17-(2-methyl-1,3-dioxolan-2-yl)-2,3,4,5,6,7,8,9,11,12,14,15-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate
SYSTEMATIC NAME: [10,13-dimethyl-17-(2-methyl-1,3-dioxolan-2-yl)-2,3,4,5,6,7,8,9,11,12,14,15-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] ethanoate
MOLECULAR FORMULA: C25H38O4
MOLECULAR WEIGHT: 402.56682
SMILES: CC(=O)OC1CCC2(C(C1)CCC3C2CCC4(C3CC=C4C5(OCCO5)C)C)C
Structure:
CAS RN: 7512-56-3
CAS Name: 2-octadecyl-1,1-dioxo-1,2-benzothiazol-3-one
OPENEYE Name: 2-octadecyl-1,1-dioxo-1,2-benzothiazol-3-one
IUPAC Name: 2-octadecyl-1,1-dioxo-1,2-benzothiazol-3-one
SYSTEMATIC NAME: 2-octadecyl-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one
MOLECULAR FORMULA: C25H41NO3S
MOLECULAR WEIGHT: 435.66294
SMILES: CCCCCCCCCCCCCCCCCCN1C(=O)C2=CC=CC=C2S1(=O)=O
Structure:
CAS RN: 7469-15-0
CAS Name: 2-hexadecyl-1,1-dioxo-1,2-benzothiazol-3-one
OPENEYE Name: 2-hexadecyl-1,1-dioxo-1,2-benzothiazol-3-one
IUPAC Name: 2-hexadecyl-1,1-dioxo-1,2-benzothiazol-3-one
SYSTEMATIC NAME: 2-hexadecyl-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one
MOLECULAR FORMULA: C23H37NO3S
MOLECULAR WEIGHT: 407.60978
SMILES: CCCCCCCCCCCCCCCCN1C(=O)C2=CC=CC=C2S1(=O)=O
Structure:
CAS RN: 7469-14-9
CAS Name: 2-(4-methoxyphenyl)-5,6,7,8-tetrahydro-1H-quinolin-4-one
OPENEYE Name: 2-(4-methoxyphenyl)-5,6,7,8-tetrahydro-1H-quinolin-4-one
IUPAC Name: 2-(4-methoxyphenyl)-5,6,7,8-tetrahydro-1H-quinolin-4-one
SYSTEMATIC NAME: 2-(4-methoxyphenyl)-5,6,7,8-tetrahydro-1H-quinolin-4-one
MOLECULAR FORMULA: C16H17NO2
MOLECULAR WEIGHT: 255.31168
SMILES: COC1=CC=C(C=C1)C2=CC(=O)C3=C(N2)CCCC3
Structure:
CAS RN: 7469-11-6
CAS Name: N2,N8-dihexyl-6-(4-morpholinyl)-7H-purine-2,8-diamine
OPENEYE Name: N2,N8-dihexyl-6-morpholino-7H-purine-2,8-diamine
IUPAC Name: 2-N,8-N-dihexyl-6-morpholin-4-yl-7H-purine-2,8-diamine
SYSTEMATIC NAME: N2,N8-dihexyl-6-morpholin-4-yl-7H-purine-2,8-diamine
MOLECULAR FORMULA: C21H37N7O
MOLECULAR WEIGHT: 403.56478
SMILES: CCCCCCNC1=NC2=C(N1)C(=NC(=N2)NCCCCCC)N3CCOCC3
Structure:
CAS RN: 7469-10-5
CAS Name: N2,N8-bis(2-furanylmethyl)-6-(4-morpholinyl)-7H-purine-2,8-diamine
OPENEYE Name: N2,N8-bis(2-furylmethyl)-6-morpholino-7H-purine-2,8-diamine
IUPAC Name: 2-N,8-N-bis(furan-2-ylmethyl)-6-morpholin-4-yl-7H-purine-2,8-diamine
SYSTEMATIC NAME: N2,N8-bis(furan-2-ylmethyl)-6-morpholin-4-yl-7H-purine-2,8-diamine
MOLECULAR FORMULA: C19H21N7O3
MOLECULAR WEIGHT: 395.41514
SMILES: C1COCCN1C2=NC(=NC3=C2NC(=N3)NCC4=CC=CO4)NCC5=CC=CO5
Structure:
CAS RN: 7469-09-2
CAS Name: 3-(diethylamino)-1-(4-methyl-2-phenyl-5-pyrimidinyl)-1-propanone
OPENEYE Name: 3-(diethylamino)-1-(4-methyl-2-phenyl-pyrimidin-5-yl)propan-1-one
IUPAC Name: 3-(diethylamino)-1-(4-methyl-2-phenylpyrimidin-5-yl)propan-1-one
SYSTEMATIC NAME: 3-(diethylamino)-1-(4-methyl-2-phenyl-pyrimidin-5-yl)propan-1-one
MOLECULAR FORMULA: C18H23N3O
MOLECULAR WEIGHT: 297.39472
SMILES: CCN(CC)CCC(=O)C1=CN=C(N=C1C)C2=CC=CC=C2
Structure:
CAS RN: 7471-84-3
CAS Name: 1-[6-[(dimethylamino)methyl]-2-phenyl-4-pyrimidinyl]ethanol
OPENEYE Name: 1-[6-[(dimethylamino)methyl]-2-phenyl-pyrimidin-4-yl]ethanol
IUPAC Name: 1-[6-[(dimethylamino)methyl]-2-phenylpyrimidin-4-yl]ethanol
SYSTEMATIC NAME: 1-[6-[(dimethylamino)methyl]-2-phenyl-pyrimidin-4-yl]ethanol
MOLECULAR FORMULA: C15H19N3O
MOLECULAR WEIGHT: 257.33086
SMILES: CC(C1=NC(=NC(=C1)CN(C)C)C2=CC=CC=C2)O
Structure:
CAS RN: 7505-84-2
CAS Name: 3-anilino-3-methyl-1-isobenzofuranone
OPENEYE Name: 3-anilino-3-methyl-isobenzofuran-1-one
IUPAC Name: 3-anilino-3-methyl-2-benzofuran-1-one
SYSTEMATIC NAME: 3-methyl-3-phenylazanyl-2-benzofuran-1-one
MOLECULAR FORMULA: C15H13NO2
MOLECULAR WEIGHT: 239.26922
SMILES: CC1(C2=CC=CC=C2C(=O)O1)NC3=CC=CC=C3
Structure:
CAS RN: 7494-72-6
CAS Name: 2-[(2-nitrophenyl)methyl]-1H-quinazolin-4-one
OPENEYE Name: 2-[(2-nitrophenyl)methyl]-1H-quinazolin-4-one
IUPAC Name: 2-[(2-nitrophenyl)methyl]-1H-quinazolin-4-one
SYSTEMATIC NAME: 2-[(2-nitrophenyl)methyl]-1H-quinazolin-4-one
MOLECULAR FORMULA: C15H11N3O3
MOLECULAR WEIGHT: 281.26614
SMILES: C1=CC=C(C(=C1)CC2=NC(=O)C3=CC=CC=C3N2)[N+](=O)[O-]
Structure:
CAS RN: 7471-82-1
CAS Name: 5,6-dimethyl-2,3-dihydrofuro[3,2-g][1]benzopyran-7-one
OPENEYE Name: 5,6-dimethyl-2,3-dihydrofuro[3,2-g]chromen-7-one
IUPAC Name: 5,6-dimethyl-2,3-dihydrofuro[3,2-g]chromen-7-one
SYSTEMATIC NAME: 5,6-dimethyl-2,3-dihydrofuro[3,2-g]chromen-7-one
MOLECULAR FORMULA: C13H12O3
MOLECULAR WEIGHT: 216.23258
SMILES: CC1=C(C(=O)OC2=CC3=C(CCO3)C=C12)C
Structure:
CAS RN: 7505-83-1
CAS Name: 2-chloro-1-(6-chloro-5-methyl-2-phenyl-4-pyrimidinyl)ethanone
OPENEYE Name: 2-chloro-1-(6-chloro-5-methyl-2-phenyl-pyrimidin-4-yl)ethanone
IUPAC Name: 2-chloro-1-(6-chloro-5-methyl-2-phenylpyrimidin-4-yl)ethanone
SYSTEMATIC NAME: 2-chloranyl-1-(6-chloranyl-5-methyl-2-phenyl-pyrimidin-4-yl)ethanone
MOLECULAR FORMULA: C13H10Cl2N2O
MOLECULAR WEIGHT: 281.1373
SMILES: CC1=C(N=C(N=C1Cl)C2=CC=CC=C2)C(=O)CCl
Structure:
CAS RN: 7471-81-0
CAS Name: 4-(4-quinazolinyl)morpholine
OPENEYE Name: 4-quinazolin-4-ylmorpholine
IUPAC Name: 4-quinazolin-4-ylmorpholine
SYSTEMATIC NAME: 4-quinazolin-4-ylmorpholine
MOLECULAR FORMULA: C12H13N3O
MOLECULAR WEIGHT: 215.25112
SMILES: C1COCCN1C2=NC=NC3=CC=CC=C32
Structure:
CAS RN: 7471-80-9
CAS Name: N-(2,5-diacetylphenyl)acetamide
OPENEYE Name: N-(2,5-diacetylphenyl)acetamide
IUPAC Name: N-(2,5-diacetylphenyl)acetamide
SYSTEMATIC NAME: N-(2,5-diethanoylphenyl)ethanamide
MOLECULAR FORMULA: C12H13NO3
MOLECULAR WEIGHT: 219.23652
SMILES: CC(=O)C1=CC(=C(C=C1)C(=O)C)NC(=O)C
Structure:
CAS RN: 7471-79-6
CAS Name: 7-(1,2-dihydroxyethoxy)-4-methyl-1-benzopyran-2-one
OPENEYE Name: 7-(1,2-dihydroxyethoxy)-4-methyl-chromen-2-one
IUPAC Name: 7-(1,2-dihydroxyethoxy)-4-methylchromen-2-one
SYSTEMATIC NAME: 7-[1,2-bis(oxidanyl)ethoxy]-4-methyl-chromen-2-one
MOLECULAR FORMULA: C12H12O5
MOLECULAR WEIGHT: 236.22068
SMILES: CC1=CC(=O)OC2=C1C=CC(=C2)OC(CO)O
Structure:
CAS RN: 7471-78-5
CAS Name: 1-(2,4-dimethyl-7-quinazolinyl)ethanone
OPENEYE Name: 1-(2,4-dimethylquinazolin-7-yl)ethanone
IUPAC Name: 1-(2,4-dimethylquinazolin-7-yl)ethanone
SYSTEMATIC NAME: 1-(2,4-dimethylquinazolin-7-yl)ethanone
MOLECULAR FORMULA: C12H12N2O
MOLECULAR WEIGHT: 200.23648
SMILES: CC1=NC(=NC2=C1C=CC(=C2)C(=O)C)C
Structure:
CAS RN: 1930-59-2
CAS Name: 4-amino-9-methoxy-2,3-dihydrofuro[3,2-g][1]benzopyran-7-one
OPENEYE Name: 4-amino-9-methoxy-2,3-dihydrofuro[3,2-g]chromen-7-one
IUPAC Name: 4-amino-9-methoxy-2,3-dihydrofuro[3,2-g]chromen-7-one
SYSTEMATIC NAME: 4-azanyl-9-methoxy-2,3-dihydrofuro[3,2-g]chromen-7-one
MOLECULAR FORMULA: C12H11NO4
MOLECULAR WEIGHT: 233.22004
SMILES: COC1=C2C(=C(C3=C1OCC3)N)C=CC(=O)O2
Structure:
CAS RN: 155272-56-3
CAS Name: 7-(2-bromoethoxy)-4-methyl-1-benzopyran-2-one
OPENEYE Name: 7-(2-bromoethoxy)-4-methyl-chromen-2-one
IUPAC Name: 7-(2-bromoethoxy)-4-methylchromen-2-one
SYSTEMATIC NAME: 7-(2-bromoethyloxy)-4-methyl-chromen-2-one
MOLECULAR FORMULA: C12H11BrO3
MOLECULAR WEIGHT: 283.11794
SMILES: CC1=CC(=O)OC2=C1C=CC(=C2)OCCBr
Structure:
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