CAS RN: 7501-39-5
CAS Name: 2-[hydroxy-[(2-nitrophenyl)-oxomethyl]amino]benzoic acid
OPENEYE Name: 2-[hydroxy-(2-nitrobenzoyl)amino]benzoic acid
IUPAC Name: 2-[hydroxy-(2-nitrobenzoyl)amino]benzoic acid
SYSTEMATIC NAME: 2-[(2-nitrophenyl)carbonyl-oxidanyl-amino]benzoic acid
MOLECULAR FORMULA: C14H10N2O6
MOLECULAR WEIGHT: 302.239
SMILES: C1=CC=C(C(=C1)C(=O)O)N(C(=O)C2=CC=CC=C2[N+](=O)[O-])O
Structure:
CAS RN: 5233-45-4
CAS Name: 2-(2-nitrophenyl)-3,1-benzoxazin-4-one
OPENEYE Name: 2-(2-nitrophenyl)-3,1-benzoxazin-4-one
IUPAC Name: 2-(2-nitrophenyl)-3,1-benzoxazin-4-one
SYSTEMATIC NAME: 2-(2-nitrophenyl)-3,1-benzoxazin-4-one
MOLECULAR FORMULA: C14H8N2O4
MOLECULAR WEIGHT: 268.22432
SMILES: C1=CC=C2C(=C1)C(=O)OC(=N2)C3=CC=CC=C3[N+](=O)[O-]
Structure:
CAS RN: 7501-38-4
CAS Name: 2-(2-nitrophenyl)-3,1-benzoxazin-4-one
OPENEYE Name: 2-(2-nitrophenyl)-3,1-benzoxazin-4-one
IUPAC Name: 2-(2-nitrophenyl)-3,1-benzoxazin-4-one
SYSTEMATIC NAME: 2-(2-nitrophenyl)-3,1-benzoxazin-4-one
MOLECULAR FORMULA: C14H8N2O4
MOLECULAR WEIGHT: 268.22432
SMILES: C1=CC=C2C(=C1)C(=O)OC(=N2)C3=CC=CC=C3[N+](=O)[O-]
Structure:
CAS RN: 7501-37-3
CAS Name: 4-(4-propan-2-ylphenyl)butanoic acid
OPENEYE Name: 4-(4-isopropylphenyl)butanoic acid
IUPAC Name: 4-(4-propan-2-ylphenyl)butanoic acid
SYSTEMATIC NAME: 4-(4-propan-2-ylphenyl)butanoic acid
MOLECULAR FORMULA: C13H18O2
MOLECULAR WEIGHT: 206.28082
SMILES: CC(C)C1=CC=C(C=C1)CCCC(=O)O
Structure:
CAS RN: 7501-36-2
CAS Name: 1-(2-nitrophenyl)-2,1-benzoxazol-3-one
OPENEYE Name: 1-(2-nitrophenyl)-2,1-benzoxazol-3-one
IUPAC Name: 1-(2-nitrophenyl)-2,1-benzoxazol-3-one
SYSTEMATIC NAME: 1-(2-nitrophenyl)-2,1-benzoxazol-3-one
MOLECULAR FORMULA: C13H8N2O4
MOLECULAR WEIGHT: 256.21362
SMILES: C1=CC=C2C(=C1)C(=O)ON2C3=CC=CC=C3[N+](=O)[O-]
Structure:
CAS RN: 4521-23-7
CAS Name: 4-(4-methylphenyl)butanamide
OPENEYE Name: 4-(p-tolyl)butanamide
IUPAC Name: 4-(4-methylphenyl)butanamide
SYSTEMATIC NAME: 4-(4-methylphenyl)butanamide
MOLECULAR FORMULA: C11H15NO
MOLECULAR WEIGHT: 177.2429
SMILES: CC1=CC=C(C=C1)CCCC(=O)N
Structure:
CAS RN: 7501-34-0
CAS Name: 1-bromo-7-methylnaphthalene; 2,4,6-trinitrophenol
OPENEYE Name: 1-bromo-7-methyl-naphthalene; picric acid
IUPAC Name: 1-bromo-7-methylnaphthalene; 2,4,6-trinitrophenol
SYSTEMATIC NAME: 1-bromanyl-7-methyl-naphthalene; 2,4,6-trinitrophenol
MOLECULAR FORMULA: C17H12BrN3O7
MOLECULAR WEIGHT: 450.19708
SMILES: CC1=CC2=C(C=CC=C2Br)C=C1.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 7501-33-9
CAS Name: 1-methyl-5-[2-(7-methyl-1-naphthalenyl)ethyl]naphthalene; 2,4,6-trinitrobenzene-1,3-diol
OPENEYE Name: 1-methyl-5-[2-(7-methyl-1-naphthyl)ethyl]naphthalene; 2,4,6-trinitrobenzene-1,3-diol
IUPAC Name: 1-methyl-5-[2-(7-methylnaphthalen-1-yl)ethyl]naphthalene; 2,4,6-trinitrobenzene-1,3-diol
SYSTEMATIC NAME: 1-methyl-5-[2-(7-methylnaphthalen-1-yl)ethyl]naphthalene; 2,4,6-trinitrobenzene-1,3-diol
MOLECULAR FORMULA: C30H25N3O8
MOLECULAR WEIGHT: 555.5348
SMILES: CC1=CC2=C(C=CC=C2CCC3=CC=CC4=C3C=CC=C4C)C=C1.C1=C(C(=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])O)[N+](=O)[O-]
Structure:
CAS RN: 89792-79-0
CAS Name: N-(4-amino-2,6-dichloro-5-pyrimidinyl)-N-ethylformamide
OPENEYE Name: N-(4-amino-2,6-dichloro-pyrimidin-5-yl)-N-ethyl-formamide
IUPAC Name: N-(4-amino-2,6-dichloropyrimidin-5-yl)-N-ethylformamide
SYSTEMATIC NAME: N-[4-azanyl-2,6-bis(chloranyl)pyrimidin-5-yl]-N-ethyl-methanamide
MOLECULAR FORMULA: C7H8Cl2N4O
MOLECULAR WEIGHT: 235.07062
SMILES: CCN(C=O)C1=C(N=C(N=C1Cl)Cl)N
Structure:
CAS RN: 93569-41-6
CAS Name: N-[4-amino-2,6-bis(methylthio)-5-pyrimidinyl]-N-(phenylmethyl)formamide
OPENEYE Name: N-[4-amino-2,6-bis(methylsulfanyl)pyrimidin-5-yl]-N-benzyl-formamide
IUPAC Name: N-[4-amino-2,6-bis(methylsulfanyl)pyrimidin-5-yl]-N-benzylformamide
SYSTEMATIC NAME: N-[4-azanyl-2,6-bis(methylsulfanyl)pyrimidin-5-yl]-N-(phenylmethyl)methanamide
MOLECULAR FORMULA: C14H16N4OS2
MOLECULAR WEIGHT: 320.43304
SMILES: CSC1=NC(=NC(=C1N(CC2=CC=CC=C2)C=O)N)SC
Structure:
CAS RN: 7595-53-1
CAS Name: N-[4-amino-2,6-bis(methylthio)-5-pyrimidinyl]formamide
OPENEYE Name: N-[4-amino-2,6-bis(methylsulfanyl)pyrimidin-5-yl]formamide
IUPAC Name: N-[4-amino-2,6-bis(methylsulfanyl)pyrimidin-5-yl]formamide
SYSTEMATIC NAME: N-[4-azanyl-2,6-bis(methylsulfanyl)pyrimidin-5-yl]methanamide
MOLECULAR FORMULA: C7H10N4OS2
MOLECULAR WEIGHT: 230.3105
SMILES: CSC1=NC(=NC(=C1NC=O)N)SC
Structure:
CAS RN: 92296-30-5
CAS Name: N-[4-amino-6-(phenylmethylthio)-5-pyrimidinyl]-N-ethylformamide
OPENEYE Name: N-(4-amino-6-benzylsulfanyl-pyrimidin-5-yl)-N-ethyl-formamide
IUPAC Name: N-(4-amino-6-benzylsulfanylpyrimidin-5-yl)-N-ethylformamide
SYSTEMATIC NAME: N-[4-azanyl-6-(phenylmethylsulfanyl)pyrimidin-5-yl]-N-ethyl-methanamide
MOLECULAR FORMULA: C14H16N4OS
MOLECULAR WEIGHT: 288.36804
SMILES: CCN(C=O)C1=C(N=CN=C1SCC2=CC=CC=C2)N
Structure:
CAS RN: 89284-45-7
CAS Name: N-(4-amino-2,6-dichloro-5-pyrimidinyl)formamide
OPENEYE Name: N-(4-amino-2,6-dichloro-pyrimidin-5-yl)formamide
IUPAC Name: N-(4-amino-2,6-dichloropyrimidin-5-yl)formamide
SYSTEMATIC NAME: N-[4-azanyl-2,6-bis(chloranyl)pyrimidin-5-yl]methanamide
MOLECULAR FORMULA: C5H4Cl2N4O
MOLECULAR WEIGHT: 207.01746
SMILES: C(=O)NC1=C(N=C(N=C1Cl)Cl)N
Structure:
CAS RN: 91962-06-0
CAS Name: N-(4-amino-2,6-dichloro-5-pyrimidinyl)-N-(phenylmethyl)formamide
OPENEYE Name: N-(4-amino-2,6-dichloro-pyrimidin-5-yl)-N-benzyl-formamide
IUPAC Name: N-(4-amino-2,6-dichloropyrimidin-5-yl)-N-benzylformamide
SYSTEMATIC NAME: N-[4-azanyl-2,6-bis(chloranyl)pyrimidin-5-yl]-N-(phenylmethyl)methanamide
MOLECULAR FORMULA: C12H10Cl2N4O
MOLECULAR WEIGHT: 297.14
SMILES: C1=CC=C(C=C1)CN(C=O)C2=C(N=C(N=C2Cl)Cl)N
Structure:
CAS RN: 91398-41-3
CAS Name: N-(4-amino-6-chloro-5-pyrimidinyl)-N-(phenylmethyl)formamide
OPENEYE Name: N-(4-amino-6-chloro-pyrimidin-5-yl)-N-benzyl-formamide
IUPAC Name: N-(4-amino-6-chloropyrimidin-5-yl)-N-benzylformamide
SYSTEMATIC NAME: N-(4-azanyl-6-chloranyl-pyrimidin-5-yl)-N-(phenylmethyl)methanamide
MOLECULAR FORMULA: C12H11ClN4O
MOLECULAR WEIGHT: 262.69494
SMILES: C1=CC=C(C=C1)CN(C=O)C2=C(N=CN=C2Cl)N
Structure:
CAS RN: 7501-32-8
CAS Name: N-(4-amino-6-chloro-5-pyrimidinyl)formamide
OPENEYE Name: N-(4-amino-6-chloro-pyrimidin-5-yl)formamide
IUPAC Name: N-(4-amino-6-chloropyrimidin-5-yl)formamide
SYSTEMATIC NAME: N-(4-azanyl-6-chloranyl-pyrimidin-5-yl)methanamide
MOLECULAR FORMULA: C5H5ClN4O
MOLECULAR WEIGHT: 172.5724
SMILES: C1=NC(=C(C(=N1)Cl)NC=O)N
Structure:
CAS RN: 7501-30-6
CAS Name: 4-amino-N'-butyl-1,2,5-thiadiazole-3-carboximidamide
OPENEYE Name: 4-amino-N'-butyl-1,2,5-thiadiazole-3-carboxamidine
IUPAC Name: 4-amino-N'-butyl-1,2,5-thiadiazole-3-carboximidamide
SYSTEMATIC NAME: 4-azanyl-N'-butyl-1,2,5-thiadiazole-3-carboximidamide
MOLECULAR FORMULA: C7H13N5S
MOLECULAR WEIGHT: 199.27662
SMILES: CCCCN=C(C1=NSN=C1N)N
Structure:
CAS RN: 7086-13-7
CAS Name: 2,4,6-triphenyl-1,4-dihydro-1,3,5-triazine
OPENEYE Name: 2,4,6-triphenyl-1,4-dihydro-1,3,5-triazine
IUPAC Name: 2,4,6-triphenyl-1,4-dihydro-1,3,5-triazine
SYSTEMATIC NAME: 2,4,6-triphenyl-1,4-dihydro-1,3,5-triazine
MOLECULAR FORMULA: C21H17N3
MOLECULAR WEIGHT: 311.37978
SMILES: C1=CC=C(C=C1)C2N=C(NC(=N2)C3=CC=CC=C3)C4=CC=CC=C4
Structure:
CAS RN: 7501-24-8
CAS Name: 2-phenyl-1,3-dihydro-[1,3,2]diazaphospholo[4,5-b]pyridine 2-oxide
OPENEYE Name: 2-phenyl-1,3-dihydro-[1,3,2]diazaphospholo[4,5-b]pyridine 2-oxide
IUPAC Name: 2-phenyl-1,3-dihydro-[1,3,2]diazaphospholo[4,5-b]pyridine 2-oxide
SYSTEMATIC NAME: 2-phenyl-1,3-dihydro-[1,3,2]diazaphospholo[4,5-b]pyridine 2-oxide
MOLECULAR FORMULA: C11H10N3OP
MOLECULAR WEIGHT: 231.190361
SMILES: C1=CC=C(C=C1)P2(=O)NC3=C(N2)N=CC=C3
Structure:
CAS RN: 4413-23-4
CAS Name: 2,2,3,3-tetraphenylthiirane
OPENEYE Name: 2,2,3,3-tetraphenylthiirane
IUPAC Name: 2,2,3,3-tetraphenylthiirane
SYSTEMATIC NAME: 2,2,3,3-tetraphenylthiirane
MOLECULAR FORMULA: C26H20S
MOLECULAR WEIGHT: 364.502
SMILES: C1=CC=C(C=C1)C2(C(S2)(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5
Structure:
CAS RN: 161-86-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C26H16O2S
MOLECULAR WEIGHT: 392.46904
SMILES: C1=CC=C2C(=C1)C3(C4=CC=CC=C4O2)C5(S3)C6=CC=CC=C6OC7=CC=CC=C57
Structure:
CAS RN: 7501-22-6
CAS Name: N-(1-naphthalenyl)carbamic acid octan-2-yl ester
OPENEYE Name: 1-methylheptyl N-(1-naphthyl)carbamate
IUPAC Name: octan-2-yl N-naphthalen-1-ylcarbamate
SYSTEMATIC NAME: octan-2-yl N-naphthalen-1-ylcarbamate
MOLECULAR FORMULA: C19H25NO2
MOLECULAR WEIGHT: 299.4073
SMILES: CCCCCCC(C)OC(=O)NC1=CC=CC2=CC=CC=C21
Structure:
CAS RN: 80008-63-5
CAS Name: 2-ethoxybenzoic acid (4-methylphenyl) ester
OPENEYE Name: p-tolyl 2-ethoxybenzoate
IUPAC Name: (4-methylphenyl) 2-ethoxybenzoate
SYSTEMATIC NAME: (4-methylphenyl) 2-ethoxybenzoate
MOLECULAR FORMULA: C16H16O3
MOLECULAR WEIGHT: 256.29644
SMILES: CCOC1=CC=CC=C1C(=O)OC2=CC=C(C=C2)C
Structure:
CAS RN: 5250-48-6
CAS Name: 2-ethoxybenzoic acid heptan-3-yl ester
OPENEYE Name: 1-ethylpentyl 2-ethoxybenzoate
IUPAC Name: heptan-3-yl 2-ethoxybenzoate
SYSTEMATIC NAME: heptan-3-yl 2-ethoxybenzoate
MOLECULAR FORMULA: C16H24O3
MOLECULAR WEIGHT: 264.35996
SMILES: CCCCC(CC)OC(=O)C1=CC=CC=C1OCC
Structure:
CAS RN: 15088-81-0
CAS Name: 2-ethoxy-N-phenylbenzamide
OPENEYE Name: 2-ethoxy-N-phenyl-benzamide
IUPAC Name: 2-ethoxy-N-phenylbenzamide
SYSTEMATIC NAME: 2-ethoxy-N-phenyl-benzamide
MOLECULAR FORMULA: C15H15NO2
MOLECULAR WEIGHT: 241.2851
SMILES: CCOC1=CC=CC=C1C(=O)NC2=CC=CC=C2
Structure:
CAS RN: 22699-63-4
CAS Name: N,N-dicyclohexylformamide
OPENEYE Name: N,N-dicyclohexylformamide
IUPAC Name: N,N-dicyclohexylformamide
SYSTEMATIC NAME: N,N-dicyclohexylmethanamide
MOLECULAR FORMULA: C13H23NO
MOLECULAR WEIGHT: 209.32782
SMILES: C1CCC(CC1)N(C=O)C2CCCCC2
Structure:
CAS RN: 21276-34-6
CAS Name: 2-ethoxy-N-methylbenzamide
OPENEYE Name: 2-ethoxy-N-methyl-benzamide
IUPAC Name: 2-ethoxy-N-methylbenzamide
SYSTEMATIC NAME: 2-ethoxy-N-methyl-benzamide
MOLECULAR FORMULA: C10H13NO2
MOLECULAR WEIGHT: 179.21572
SMILES: CCOC1=CC=CC=C1C(=O)NC
Structure:
CAS RN: 138324-58-0
CAS Name: 2-ethoxy-N,N-di(propan-2-yl)benzamide
OPENEYE Name: 2-ethoxy-N,N-diisopropyl-benzamide
IUPAC Name: 2-ethoxy-N,N-di(propan-2-yl)benzamide
SYSTEMATIC NAME: 2-ethoxy-N,N-di(propan-2-yl)benzamide
MOLECULAR FORMULA: C15H23NO2
MOLECULAR WEIGHT: 249.34862
SMILES: CCOC1=CC=CC=C1C(=O)N(C(C)C)C(C)C
Structure:
CAS RN: 20308-27-4
CAS Name: 2-ethoxy-N-(phenylmethyl)benzamide
OPENEYE Name: N-benzyl-2-ethoxy-benzamide
IUPAC Name: N-benzyl-2-ethoxybenzamide
SYSTEMATIC NAME: 2-ethoxy-N-(phenylmethyl)benzamide
MOLECULAR FORMULA: C16H17NO2
MOLECULAR WEIGHT: 255.31168
SMILES: CCOC1=CC=CC=C1C(=O)NCC2=CC=CC=C2
Structure:
CAS RN: 15823-54-8
CAS Name: N,N-dibutyl-2-ethoxybenzamide
OPENEYE Name: N,N-dibutyl-2-ethoxy-benzamide
IUPAC Name: N,N-dibutyl-2-ethoxybenzamide
SYSTEMATIC NAME: N,N-dibutyl-2-ethoxy-benzamide
MOLECULAR FORMULA: C17H27NO2
MOLECULAR WEIGHT: 277.40178
SMILES: CCCCN(CCCC)C(=O)C1=CC=CC=C1OCC
Structure:
CAS RN: 15823-53-7
CAS Name: N-butyl-2-ethoxybenzamide
OPENEYE Name: N-butyl-2-ethoxy-benzamide
IUPAC Name: N-butyl-2-ethoxybenzamide
SYSTEMATIC NAME: N-butyl-2-ethoxy-benzamide
MOLECULAR FORMULA: C13H19NO2
MOLECULAR WEIGHT: 221.29546
SMILES: CCCCNC(=O)C1=CC=CC=C1OCC
Structure:
CAS RN: 79515-58-5
CAS Name: 2-ethoxybenzoic acid phenyl ester
OPENEYE Name: phenyl 2-ethoxybenzoate
IUPAC Name: phenyl 2-ethoxybenzoate
SYSTEMATIC NAME: phenyl 2-ethoxybenzoate
MOLECULAR FORMULA: C15H14O3
MOLECULAR WEIGHT: 242.26986
SMILES: CCOC1=CC=CC=C1C(=O)OC2=CC=CC=C2
Structure:
CAS RN: 33405-95-7
CAS Name: 2-ethoxybenzoic acid (4-methoxyphenyl)methyl ester
OPENEYE Name: (4-methoxyphenyl)methyl 2-ethoxybenzoate
IUPAC Name: (4-methoxyphenyl)methyl 2-ethoxybenzoate
SYSTEMATIC NAME: (4-methoxyphenyl)methyl 2-ethoxybenzoate
MOLECULAR FORMULA: C17H18O4
MOLECULAR WEIGHT: 286.32242
SMILES: CCOC1=CC=CC=C1C(=O)OCC2=CC=C(C=C2)OC
Structure:
CAS RN: 20306-24-5
CAS Name: 2-ethoxybenzoic acid 2-methoxyethyl ester
OPENEYE Name: 2-methoxyethyl 2-ethoxybenzoate
IUPAC Name: 2-methoxyethyl 2-ethoxybenzoate
SYSTEMATIC NAME: 2-methoxyethyl 2-ethoxybenzoate
MOLECULAR FORMULA: C12H16O4
MOLECULAR WEIGHT: 224.25304
SMILES: CCOC1=CC=CC=C1C(=O)OCCOC
Structure:
CAS RN: 5250-47-5
CAS Name: 2-ethoxybenzoic acid 2-methoxyethyl ester
OPENEYE Name: 2-methoxyethyl 2-ethoxybenzoate
IUPAC Name: 2-methoxyethyl 2-ethoxybenzoate
SYSTEMATIC NAME: 2-methoxyethyl 2-ethoxybenzoate
MOLECULAR FORMULA: C12H16O4
MOLECULAR WEIGHT: 224.25304
SMILES: CCOC1=CC=CC=C1C(=O)OCCOC
Structure:
CAS RN: 20013-80-3
CAS Name: 1,2,7-trimethylnaphthalene; 2,4,6-trinitrophenol
OPENEYE Name: picric acid; 1,2,7-trimethylnaphthalene
IUPAC Name: 1,2,7-trimethylnaphthalene; 2,4,6-trinitrophenol
SYSTEMATIC NAME: 1,2,7-trimethylnaphthalene; 2,4,6-trinitrophenol
MOLECULAR FORMULA: C19H17N3O7
MOLECULAR WEIGHT: 399.35418
SMILES: CC1=CC2=C(C=C1)C=CC(=C2C)C.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 7505-36-4
CAS Name: 2-formamido-3-methoxybutanoic acid
OPENEYE Name: 2-formamido-3-methoxy-butanoic acid
IUPAC Name: 2-formamido-3-methoxybutanoic acid
SYSTEMATIC NAME: 2-formamido-3-methoxy-butanoic acid
MOLECULAR FORMULA: C6H11NO4
MOLECULAR WEIGHT: 161.15584
SMILES: CC(C(C(=O)O)NC=O)OC
Structure:
CAS RN: 7505-34-2
CAS Name: N,10,13-trimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3-sulfenamide
OPENEYE Name: N-[[17-(1,5-dimethylhexyl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]sulfanyl]methanamine
IUPAC Name: N-[[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]sulfanyl]methanamine
SYSTEMATIC NAME: N-[[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]sulfanyl]methanamine
MOLECULAR FORMULA: C28H49NS
MOLECULAR WEIGHT: 431.76036
SMILES: CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)SNC)C)C
Structure:
CAS RN: 7505-32-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C29H37N3O7
MOLECULAR WEIGHT: 539.61998
SMILES: CC(C)C(C(=O)O)NC=O.COC1=C(C=C2C(=C1)C34CCN5C3CC6C7C4N2C(=O)CC7OCC=C6C5)OC
Structure:
CAS RN: 7505-30-8
CAS Name: benzene-1,3,5-triol; N'-phenylcarbamimidothioic acid ethyl ester
OPENEYE Name: benzene-1,3,5-triol; 2-ethyl-3-phenyl-isothiourea
IUPAC Name: benzene-1,3,5-triol; ethyl N'-phenylcarbamimidothioate
SYSTEMATIC NAME: benzene-1,3,5-triol; ethyl N'-phenylcarbamimidothioate
MOLECULAR FORMULA: C15H18N2O3S
MOLECULAR WEIGHT: 306.38002
SMILES: CCSC(=NC1=CC=CC=C1)N.C1=C(C=C(C=C1O)O)O
Structure:
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