CAS RN: 58482-93-2
CAS Name: sodium 2-(tert-butylamino)acetate
OPENEYE Name: sodium 2-(tert-butylamino)acetate
IUPAC Name: sodium 2-(tert-butylamino)acetate
SYSTEMATIC NAME: sodium 2-(tert-butylamino)ethanoate
MOLECULAR FORMULA: C6H12NNaO2
MOLECULAR WEIGHT: 153.15475
SMILES: CC(C)(C)NCC(=O)[O-].[Na+]
Structure:
CAS RN: 91066-18-1
CAS Name: 2-[(7-chloro-4-quinolinyl)amino]ethanol
OPENEYE Name: 2-[(7-chloro-4-quinolyl)amino]ethanol
IUPAC Name: 2-[(7-chloroquinolin-4-yl)amino]ethanol
SYSTEMATIC NAME: 2-[(7-chloranylquinolin-4-yl)amino]ethanol
MOLECULAR FORMULA: C11H11ClN2O
MOLECULAR WEIGHT: 222.67084
SMILES: C1=CC2=C(C=CN=C2C=C1Cl)NCCO
Structure:
CAS RN: 32403-39-7
CAS Name: 1-(1-adamantyl)-3-[(3,4-dimethoxyphenyl)methylideneamino]thiourea
OPENEYE Name: 1-(1-adamantyl)-3-[(3,4-dimethoxyphenyl)methyleneamino]thiourea
IUPAC Name: 1-(1-adamantyl)-3-[(3,4-dimethoxyphenyl)methylideneamino]thiourea
SYSTEMATIC NAME: 1-(1-adamantyl)-3-[(3,4-dimethoxyphenyl)methylideneamino]thiourea
MOLECULAR FORMULA: C20H27N3O2S
MOLECULAR WEIGHT: 373.51228
SMILES: COC1=C(C=C(C=C1)C=NNC(=S)NC23CC4CC(C2)CC(C4)C3)OC
Structure:
CAS RN: 41253-21-8
CAS Name: sodium 2,4-diaza-1-azanidacyclopenta-2,4-diene
OPENEYE Name: sodium 2,4-diaza-1-azanidacyclopenta-2,4-diene
IUPAC Name: sodium 2,4-diaza-1-azanidacyclopenta-2,4-diene
SYSTEMATIC NAME: sodium 2,4-diaza-1-azanidacyclopenta-2,4-diene
MOLECULAR FORMULA: C2H2N3Na
MOLECULAR WEIGHT: 91.04715
SMILES: C1=NC=N[N-]1.[Na+]
Structure:
CAS RN: 117547-14-5
CAS Name: sodium 2,4-diaza-1-azanidacyclopenta-2,4-diene
OPENEYE Name: sodium 2,4-diaza-1-azanidacyclopenta-2,4-diene
IUPAC Name: sodium 2,4-diaza-1-azanidacyclopenta-2,4-diene
SYSTEMATIC NAME: sodium 2,4-diaza-1-azanidacyclopenta-2,4-diene
MOLECULAR FORMULA: C2H2N3Na
MOLECULAR WEIGHT: 91.04715
SMILES: C1=NC=N[N-]1.[Na+]
Structure:
CAS RN: 7151-59-9
CAS Name: N-(7-nitro-9-oxo-2-fluorenyl)acetamide
OPENEYE Name: N-(7-nitro-9-oxo-fluoren-2-yl)acetamide
IUPAC Name: N-(7-nitro-9-oxofluoren-2-yl)acetamide
SYSTEMATIC NAME: N-(7-nitro-9-oxidanylidene-fluoren-2-yl)ethanamide
MOLECULAR FORMULA: C15H10N2O4
MOLECULAR WEIGHT: 282.2509
SMILES: CC(=O)NC1=CC2=C(C=C1)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-]
Structure:
CAS RN: 13039-47-9
CAS Name: 2-amino-9-[4-hydroxy-5-(hydroxymethyl)-3-methoxy-2-oxolanyl]-3H-purine-6-thione
OPENEYE Name: 2-amino-9-[4-hydroxy-5-(hydroxymethyl)-3-methoxy-tetrahydrofuran-2-yl]-3H-purine-6-thione
IUPAC Name: 2-amino-9-[4-hydroxy-5-(hydroxymethyl)-3-methoxyoxolan-2-yl]-3H-purine-6-thione
SYSTEMATIC NAME: 2-azanyl-9-[5-(hydroxymethyl)-3-methoxy-4-oxidanyl-oxolan-2-yl]-3H-purine-6-thione
MOLECULAR FORMULA: C11H15N5O4S
MOLECULAR WEIGHT: 313.3329
SMILES: COC1C(C(OC1N2C=NC3=C2NC(=NC3=S)N)CO)O
Structure:
CAS RN: 91037-65-9
CAS Name: 3-[[2-[[2-amino-5-(diaminomethylideneamino)-1-oxopentyl]amino]-1-oxoethyl]amino]-4-[(1-carboxy-2-hydroxyethyl)amino]-4-oxobutanoic acid
OPENEYE Name: 3-[[2-[(2-amino-5-guanidino-pentanoyl)amino]acetyl]amino]-4-[(1-carboxy-2-hydroxy-ethyl)amino]-4-oxo-butanoic acid
IUPAC Name: 3-[[2-[[2-amino-5-(diaminomethylideneamino)pentanoyl]amino]acetyl]amino]-4-[(1-carboxy-2-hydroxyethyl)amino]-4-oxobutanoic acid
SYSTEMATIC NAME: 3-[2-[[2-azanyl-5-[bis(azanyl)methylideneamino]pentanoyl]amino]ethanoylamino]-4-[[1,3-bis(oxidanyl)-1-oxidanylidene-propan-2-yl]amino]-4-oxidanylidene-butanoic acid
MOLECULAR FORMULA: C15H27N7O8
MOLECULAR WEIGHT: 433.41698
SMILES: C(CC(C(=O)NCC(=O)NC(CC(=O)O)C(=O)NC(CO)C(=O)O)N)CN=C(N)N
Structure:
CAS RN: 7338-77-4
CAS Name: 5-oxo-3-sulfanylidene-2H-1,2,4-triazine-6-carboxamide
OPENEYE Name: 5-oxo-3-thioxo-2H-1,2,4-triazine-6-carboxamide
IUPAC Name: 5-oxo-3-sulfanylidene-2H-1,2,4-triazine-6-carboxamide
SYSTEMATIC NAME: 5-oxidanylidene-3-sulfanylidene-2H-1,2,4-triazine-6-carboxamide
MOLECULAR FORMULA: C4H4N4O2S
MOLECULAR WEIGHT: 172.16516
SMILES: C1(=NNC(=S)NC1=O)C(=O)N
Structure:
CAS RN: 72519-11-0
CAS Name: 2-azido-3,5,6-trichlorocyclohexa-2,5-diene-1,4-dione
OPENEYE Name: 2-azido-3,5,6-trichloro-1,4-benzoquinone
IUPAC Name: 2-azido-3,5,6-trichlorocyclohexa-2,5-diene-1,4-dione
SYSTEMATIC NAME: 2-azido-3,5,6-tris(chloranyl)cyclohexa-2,5-diene-1,4-dione
MOLECULAR FORMULA: C6Cl3N3O2
MOLECULAR WEIGHT: 252.4421
SMILES: C1(=C(C(=O)C(=C(C1=O)Cl)Cl)Cl)N=[N+]=[N-]
Structure:
CAS RN: 51933-47-2
CAS Name: 1-(1-naphthalenyl)-3-(1-sulfanylideneethyl)urea
OPENEYE Name: 1-ethanethioyl-3-(1-naphthyl)urea
IUPAC Name: 1-ethanethioyl-3-naphthalen-1-ylurea
SYSTEMATIC NAME: 1-ethanethioyl-3-naphthalen-1-yl-urea
MOLECULAR FORMULA: C13H12N2OS
MOLECULAR WEIGHT: 244.31218
SMILES: CC(=S)NC(=O)NC1=CC=CC2=CC=CC=C21
Structure:
CAS RN: 36603-49-3
CAS Name: 2-(4-bromophenoxy)oxane
OPENEYE Name: 2-(4-bromophenoxy)tetrahydropyran
IUPAC Name: 2-(4-bromophenoxy)oxane
SYSTEMATIC NAME: 2-(4-bromanylphenoxy)oxane
MOLECULAR FORMULA: C11H13BrO2
MOLECULAR WEIGHT: 257.12372
SMILES: C1CCOC(C1)OC2=CC=C(C=C2)Br
Structure:
CAS RN: 454451-28-6
CAS Name: N-(4-azepanyl)carbamic acid tert-butyl ester
OPENEYE Name: tert-butyl N-(azepan-4-yl)carbamate
IUPAC Name: tert-butyl N-(azepan-4-yl)carbamate
SYSTEMATIC NAME: tert-butyl N-(azepan-4-yl)carbamate
MOLECULAR FORMULA: C11H22N2O2
MOLECULAR WEIGHT: 214.30458
SMILES: CC(C)(C)OC(=O)NC1CCCNCC1
Structure:
CAS RN: 20389-09-7
CAS Name: 2-(2-chlorophenyl)-4-quinolinecarboxylate
OPENEYE Name: 2-(2-chlorophenyl)quinoline-4-carboxylate
IUPAC Name: 2-(2-chlorophenyl)quinoline-4-carboxylate
SYSTEMATIC NAME: 2-(2-chlorophenyl)quinoline-4-carboxylate
MOLECULAR FORMULA: C16H9ClNO2-
MOLECULAR WEIGHT: 282.70116
SMILES: C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CC=C3Cl)C(=O)[O-]
Structure:
CAS RN: 824-54-4
CAS Name: 2-bromo-4-methylbenzaldehyde
OPENEYE Name: 2-bromo-4-methyl-benzaldehyde
IUPAC Name: 2-bromo-4-methylbenzaldehyde
SYSTEMATIC NAME: 2-bromanyl-4-methyl-benzaldehyde
MOLECULAR FORMULA: C8H7BrO
MOLECULAR WEIGHT: 199.04458
SMILES: CC1=CC(=C(C=C1)C=O)Br
Structure:
CAS RN: 59008-19-4
CAS Name: 5,6-diamino-1-(phenylmethyl)-2-sulfanylidene-4-pyrimidinone
OPENEYE Name: 5,6-diamino-1-benzyl-2-thioxo-pyrimidin-4-one
IUPAC Name: 5,6-diamino-1-benzyl-2-sulfanylidenepyrimidin-4-one
SYSTEMATIC NAME: 5,6-bis(azanyl)-1-(phenylmethyl)-2-sulfanylidene-pyrimidin-4-one
MOLECULAR FORMULA: C11H12N4OS
MOLECULAR WEIGHT: 248.30418
SMILES: C1=CC=C(C=C1)CN2C(=C(C(=O)NC2=S)N)N
Structure:
CAS RN: 51707-40-5
CAS Name: 1-amino-3-(3-fluoro-4-methylphenyl)thiourea
OPENEYE Name: 1-amino-3-(3-fluoro-4-methyl-phenyl)thiourea
IUPAC Name: 1-amino-3-(3-fluoro-4-methylphenyl)thiourea
SYSTEMATIC NAME: 1-azanyl-3-(3-fluoranyl-4-methyl-phenyl)thiourea
MOLECULAR FORMULA: C8H10FN3S
MOLECULAR WEIGHT: 199.248503
SMILES: CC1=C(C=C(C=C1)NC(=S)NN)F
Structure:
CAS RN: 380626-35-7
CAS Name: 3-thiophen-2-ylbenzonitrile
OPENEYE Name: 3-(2-thienyl)benzonitrile
IUPAC Name: 3-thiophen-2-ylbenzonitrile
SYSTEMATIC NAME: 3-thiophen-2-ylbenzenecarbonitrile
MOLECULAR FORMULA: C11H7NS
MOLECULAR WEIGHT: 185.24498
SMILES: C1=CC(=CC(=C1)C2=CC=CS2)C#N
Structure:
CAS RN: 16490-63-4
CAS Name: 1-(9-anthracenyl)-N-(2,4,6-trimethylphenyl)methanimine
OPENEYE Name: 1-(9-anthryl)-N-(2,4,6-trimethylphenyl)methanimine
IUPAC Name: 1-anthracen-9-yl-N-(2,4,6-trimethylphenyl)methanimine
SYSTEMATIC NAME: 1-anthracen-9-yl-N-(2,4,6-trimethylphenyl)methanimine
MOLECULAR FORMULA: C24H21N
MOLECULAR WEIGHT: 323.43024
SMILES: CC1=CC(=C(C(=C1)C)N=CC2=C3C=CC=CC3=CC4=CC=CC=C42)C
Structure:
CAS RN: 5319-78-8
CAS Name: 1,3-bis[[anilino(sulfanylidene)methyl]amino]thiourea
OPENEYE Name: 1,3-bis(phenylcarbamothioylamino)thiourea
IUPAC Name: 1,3-bis(phenylcarbamothioylamino)thiourea
SYSTEMATIC NAME: 1,3-bis(phenylcarbamothioylamino)thiourea
MOLECULAR FORMULA: C15H16N6S3
MOLECULAR WEIGHT: 376.52274
SMILES: C1=CC=C(C=C1)NC(=S)NNC(=S)NNC(=S)NC2=CC=CC=C2
Structure:
CAS RN: 16208-03-0
CAS Name: 9-[4-[bis(2-hydroxyethyl)amino]phenyl]-3H-purine-6-thione
OPENEYE Name: 9-[4-[bis(2-hydroxyethyl)amino]phenyl]-3H-purine-6-thione
IUPAC Name: 9-[4-[bis(2-hydroxyethyl)amino]phenyl]-3H-purine-6-thione
SYSTEMATIC NAME: 9-[4-[bis(2-hydroxyethyl)amino]phenyl]-3H-purine-6-thione
MOLECULAR FORMULA: C15H17N5O2S
MOLECULAR WEIGHT: 331.39278
SMILES: C1=CC(=CC=C1N2C=NC3=C2NC=NC3=S)N(CCO)CCO
Structure:
CAS RN: 3143-70-2
CAS Name: 1-(2-chloro-4-methylphenyl)-3-diphenoxyphosphorylthiourea
OPENEYE Name: 1-(2-chloro-4-methyl-phenyl)-3-diphenoxyphosphoryl-thiourea
IUPAC Name: 1-(2-chloro-4-methylphenyl)-3-diphenoxyphosphorylthiourea
SYSTEMATIC NAME: 1-(2-chloranyl-4-methyl-phenyl)-3-diphenoxyphosphoryl-thiourea
MOLECULAR FORMULA: C20H18ClN2O3PS
MOLECULAR WEIGHT: 432.860281
SMILES: CC1=CC(=C(C=C1)NC(=S)NP(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3)Cl
Structure:
CAS RN: 36810-92-1
CAS Name: 2-(isothiocyanatomethyl)thiophene
OPENEYE Name: 2-(isothiocyanatomethyl)thiophene
IUPAC Name: 2-(isothiocyanatomethyl)thiophene
SYSTEMATIC NAME: 2-(isothiocyanatomethyl)thiophene
MOLECULAR FORMULA: C6H5NS2
MOLECULAR WEIGHT: 155.2406
SMILES: C1=CSC(=C1)CN=C=S
Structure:
CAS RN: 108682-58-2
CAS Name: 1-[2-[[2-[[2-[[2-[(2-amino-1-oxoethyl)amino]-5-(diaminomethylideneamino)-1-oxopentyl]amino]-1-oxoethyl]amino]-3-carboxy-1-oxopropyl]amino]-3-hydroxy-1-oxobutyl]-2-pyrrolidinecarboxylic acid
OPENEYE Name: 1-[2-[[2-[[2-[[2-[(2-aminoacetyl)amino]-5-guanidino-pentanoyl]amino]acetyl]amino]-3-carboxy-propanoyl]amino]-3-hydroxy-butanoyl]pyrrolidine-2-carboxylic acid
IUPAC Name: 1-[2-[[2-[[2-[[2-[(2-aminoacetyl)amino]-5-(diaminomethylideneamino)pentanoyl]amino]acetyl]amino]-3-carboxypropanoyl]amino]-3-hydroxybutanoyl]pyrrolidine-2-carboxylic acid
SYSTEMATIC NAME: 1-[2-[[2-[2-[[2-(2-azanylethanoylamino)-5-[bis(azanyl)methylideneamino]pentanoyl]amino]ethanoylamino]-4-oxidanyl-4-oxidanylidene-butanoyl]amino]-3-oxidanyl-butanoyl]pyrrolidine-2-carboxylic acid
MOLECULAR FORMULA: C23H39N9O10
MOLECULAR WEIGHT: 601.61006
SMILES: CC(C(C(=O)N1CCCC1C(=O)O)NC(=O)C(CC(=O)O)NC(=O)CNC(=O)C(CCCN=C(N)N)NC(=O)CN)O
Structure:
CAS RN: 33192-10-8
CAS Name: thiocyanic acid (4-amino-3-methylphenyl) ester
OPENEYE Name: (4-amino-3-methyl-phenyl) thiocyanate
IUPAC Name: (4-amino-3-methylphenyl) thiocyanate
SYSTEMATIC NAME: (4-azanyl-3-methyl-phenyl) thiocyanate
MOLECULAR FORMULA: C8H8N2S
MOLECULAR WEIGHT: 164.22752
SMILES: CC1=C(C=CC(=C1)SC#N)N
Structure:
CAS RN: 27587-88-8
CAS Name: 1-(2-chloroanilino)-3-methylthiourea
OPENEYE Name: 1-(2-chloroanilino)-3-methyl-thiourea
IUPAC Name: 1-(2-chloroanilino)-3-methylthiourea
SYSTEMATIC NAME: 1-[(2-chlorophenyl)amino]-3-methyl-thiourea
MOLECULAR FORMULA: C8H10ClN3S
MOLECULAR WEIGHT: 215.7031
SMILES: CNC(=S)NNC1=CC=CC=C1Cl
Structure:
CAS RN: 1314-84-7
CAS Name: phosphinidenezinc; zinc
OPENEYE Name: phosphanylidenezinc; zinc
IUPAC Name: phosphanylidenezinc; zinc
SYSTEMATIC NAME: phosphanylidenezinc; zinc
MOLECULAR FORMULA: H2P2Zn3
MOLECULAR WEIGHT: 260.190402
SMILES: P=[Zn].P=[Zn].[Zn]
Structure:
CAS RN: 39342-49-9
CAS Name: phosphinidenezinc; zinc
OPENEYE Name: phosphanylidenezinc; zinc
IUPAC Name: phosphanylidenezinc; zinc
SYSTEMATIC NAME: phosphanylidenezinc; zinc
MOLECULAR FORMULA: H2P2Zn3
MOLECULAR WEIGHT: 260.190402
SMILES: P=[Zn].P=[Zn].[Zn]
Structure:
CAS RN: 51810-70-9
CAS Name: phosphinidenezinc; zinc
OPENEYE Name: phosphanylidenezinc; zinc
IUPAC Name: phosphanylidenezinc; zinc
SYSTEMATIC NAME: phosphanylidenezinc; zinc
MOLECULAR FORMULA: H2P2Zn3
MOLECULAR WEIGHT: 260.190402
SMILES: P=[Zn].P=[Zn].[Zn]
Structure:
No comments:
Post a Comment