Thursday, March 29, 2012

http://ChemLookup.com Compounds




CAS RN: 95236-95-6
CAS Name: 4-chloro-N-(4-methylphenyl)benzenecarbothioamide
OPENEYE Name: 4-chloro-N-(p-tolyl)benzenecarbothioamide
IUPAC Name: 4-chloro-N-(4-methylphenyl)benzenecarbothioamide
SYSTEMATIC NAME: 4-chloranyl-N-(4-methylphenyl)benzenecarbothioamide
MOLECULAR FORMULA: C14H12ClNS
MOLECULAR WEIGHT: 261.76978
SMILES: CC1=CC=C(C=C1)NC(=S)C2=CC=C(C=C2)Cl
Structure:

CAS RN: 6244-75-3
CAS Name: 4-chloro-N-phenylbenzenecarbothioamide
OPENEYE Name: 4-chloro-N-phenyl-benzenecarbothioamide
IUPAC Name: 4-chloro-N-phenylbenzenecarbothioamide
SYSTEMATIC NAME: 4-chloranyl-N-phenyl-benzenecarbothioamide
MOLECULAR FORMULA: C13H10ClNS
MOLECULAR WEIGHT: 247.7432
SMILES: C1=CC=C(C=C1)NC(=S)C2=CC=C(C=C2)Cl
Structure:

CAS RN: 127351-04-6
CAS Name: N-(4-bromophenyl)-4-methoxybenzenecarbothioamide
OPENEYE Name: N-(4-bromophenyl)-4-methoxy-benzenecarbothioamide
IUPAC Name: N-(4-bromophenyl)-4-methoxybenzenecarbothioamide
SYSTEMATIC NAME: N-(4-bromophenyl)-4-methoxy-benzenecarbothioamide
MOLECULAR FORMULA: C14H12BrNOS
MOLECULAR WEIGHT: 322.22018
SMILES: COC1=CC=C(C=C1)C(=S)NC2=CC=C(C=C2)Br
Structure:

CAS RN: 127351-03-5
CAS Name: N-(3,4-dichlorophenyl)-4-methoxybenzenecarbothioamide
OPENEYE Name: N-(3,4-dichlorophenyl)-4-methoxy-benzenecarbothioamide
IUPAC Name: N-(3,4-dichlorophenyl)-4-methoxybenzenecarbothioamide
SYSTEMATIC NAME: N-(3,4-dichlorophenyl)-4-methoxy-benzenecarbothioamide
MOLECULAR FORMULA: C14H11Cl2NOS
MOLECULAR WEIGHT: 312.21424
SMILES: COC1=CC=C(C=C1)C(=S)NC2=CC(=C(C=C2)Cl)Cl
Structure:

CAS RN: 127351-02-4
CAS Name: N-(4-chlorophenyl)-4-methoxybenzenecarbothioamide
OPENEYE Name: N-(4-chlorophenyl)-4-methoxy-benzenecarbothioamide
IUPAC Name: N-(4-chlorophenyl)-4-methoxybenzenecarbothioamide
SYSTEMATIC NAME: N-(4-chlorophenyl)-4-methoxy-benzenecarbothioamide
MOLECULAR FORMULA: C14H12ClNOS
MOLECULAR WEIGHT: 277.76918
SMILES: COC1=CC=C(C=C1)C(=S)NC2=CC=C(C=C2)Cl
Structure:

CAS RN: 82020-27-7
CAS Name: 4-methoxy-N-(4-methoxyphenyl)benzenecarbothioamide
OPENEYE Name: 4-methoxy-N-(4-methoxyphenyl)benzenecarbothioamide
IUPAC Name: 4-methoxy-N-(4-methoxyphenyl)benzenecarbothioamide
SYSTEMATIC NAME: 4-methoxy-N-(4-methoxyphenyl)benzenecarbothioamide
MOLECULAR FORMULA: C15H15NO2S
MOLECULAR WEIGHT: 273.3501
SMILES: COC1=CC=C(C=C1)C(=S)NC2=CC=C(C=C2)OC
Structure:

CAS RN: 127351-06-8
CAS Name: N-(4-bromophenyl)-4-methylbenzenecarbothioamide
OPENEYE Name: N-(4-bromophenyl)-4-methyl-benzenecarbothioamide
IUPAC Name: N-(4-bromophenyl)-4-methylbenzenecarbothioamide
SYSTEMATIC NAME: N-(4-bromophenyl)-4-methyl-benzenecarbothioamide
MOLECULAR FORMULA: C14H12BrNS
MOLECULAR WEIGHT: 306.22078
SMILES: CC1=CC=C(C=C1)C(=S)NC2=CC=C(C=C2)Br
Structure:

CAS RN: 127351-05-7
CAS Name: N-(3,4-dichlorophenyl)-4-methylbenzenecarbothioamide
OPENEYE Name: N-(3,4-dichlorophenyl)-4-methyl-benzenecarbothioamide
IUPAC Name: N-(3,4-dichlorophenyl)-4-methylbenzenecarbothioamide
SYSTEMATIC NAME: N-(3,4-dichlorophenyl)-4-methyl-benzenecarbothioamide
MOLECULAR FORMULA: C14H11Cl2NS
MOLECULAR WEIGHT: 296.21484
SMILES: CC1=CC=C(C=C1)C(=S)NC2=CC(=C(C=C2)Cl)Cl
Structure:

CAS RN: 21011-45-0
CAS Name: N-(4-methoxyphenyl)-4-methylbenzenecarbothioamide
OPENEYE Name: N-(4-methoxyphenyl)-4-methyl-benzenecarbothioamide
IUPAC Name: N-(4-methoxyphenyl)-4-methylbenzenecarbothioamide
SYSTEMATIC NAME: N-(4-methoxyphenyl)-4-methyl-benzenecarbothioamide
MOLECULAR FORMULA: C15H15NOS
MOLECULAR WEIGHT: 257.3507
SMILES: CC1=CC=C(C=C1)C(=S)NC2=CC=C(C=C2)OC
Structure:

CAS RN: 53724-39-3
CAS Name: 4-methyl-N-(4-methylphenyl)benzenecarbothioamide
OPENEYE Name: 4-methyl-N-(p-tolyl)benzenecarbothioamide
IUPAC Name: 4-methyl-N-(4-methylphenyl)benzenecarbothioamide
SYSTEMATIC NAME: 4-methyl-N-(4-methylphenyl)benzenecarbothioamide
MOLECULAR FORMULA: C15H15NS
MOLECULAR WEIGHT: 241.3513
SMILES: CC1=CC=C(C=C1)C(=S)NC2=CC=C(C=C2)C
Structure:

CAS RN: 20199-06-8
CAS Name: 4-methyl-N-phenylbenzenecarbothioamide
OPENEYE Name: 4-methyl-N-phenyl-benzenecarbothioamide
IUPAC Name: 4-methyl-N-phenylbenzenecarbothioamide
SYSTEMATIC NAME: 4-methyl-N-phenyl-benzenecarbothioamide
MOLECULAR FORMULA: C14H13NS
MOLECULAR WEIGHT: 227.32472
SMILES: CC1=CC=C(C=C1)C(=S)NC2=CC=CC=C2
Structure:

CAS RN: 10278-50-9
CAS Name: N-(3,4-dichlorophenyl)benzenecarbothioamide
OPENEYE Name: N-(3,4-dichlorophenyl)benzenecarbothioamide
IUPAC Name: N-(3,4-dichlorophenyl)benzenecarbothioamide
SYSTEMATIC NAME: N-(3,4-dichlorophenyl)benzenecarbothioamide
MOLECULAR FORMULA: C13H9Cl2NS
MOLECULAR WEIGHT: 282.18826
SMILES: C1=CC=C(C=C1)C(=S)NC2=CC(=C(C=C2)Cl)Cl
Structure:

CAS RN: 147701-89-1
CAS Name: 3-bromo-N-(4-cyclohexylphenyl)benzenecarbothioamide
OPENEYE Name: 3-bromo-N-(4-cyclohexylphenyl)benzenecarbothioamide
IUPAC Name: 3-bromo-N-(4-cyclohexylphenyl)benzenecarbothioamide
SYSTEMATIC NAME: 3-bromanyl-N-(4-cyclohexylphenyl)benzenecarbothioamide
MOLECULAR FORMULA: C19H20BrNS
MOLECULAR WEIGHT: 374.3378
SMILES: C1CCC(CC1)C2=CC=C(C=C2)NC(=S)C3=CC(=CC=C3)Br
Structure:

CAS RN: 147701-88-0
CAS Name: 4-chloro-N-(4-cyclohexylphenyl)benzenecarbothioamide
OPENEYE Name: 4-chloro-N-(4-cyclohexylphenyl)benzenecarbothioamide
IUPAC Name: 4-chloro-N-(4-cyclohexylphenyl)benzenecarbothioamide
SYSTEMATIC NAME: 4-chloranyl-N-(4-cyclohexylphenyl)benzenecarbothioamide
MOLECULAR FORMULA: C19H20ClNS
MOLECULAR WEIGHT: 329.8868
SMILES: C1CCC(CC1)C2=CC=C(C=C2)NC(=S)C3=CC=C(C=C3)Cl
Structure:

CAS RN: 147701-87-9
CAS Name: N-(4-cyclohexylphenyl)-4-methoxybenzenecarbothioamide
OPENEYE Name: N-(4-cyclohexylphenyl)-4-methoxy-benzenecarbothioamide
IUPAC Name: N-(4-cyclohexylphenyl)-4-methoxybenzenecarbothioamide
SYSTEMATIC NAME: N-(4-cyclohexylphenyl)-4-methoxy-benzenecarbothioamide
MOLECULAR FORMULA: C20H23NOS
MOLECULAR WEIGHT: 325.46772
SMILES: COC1=CC=C(C=C1)C(=S)NC2=CC=C(C=C2)C3CCCCC3
Structure:

CAS RN: 147701-86-8
CAS Name: N-(4-cyclohexylphenyl)-4-methylbenzenecarbothioamide
OPENEYE Name: N-(4-cyclohexylphenyl)-4-methyl-benzenecarbothioamide
IUPAC Name: N-(4-cyclohexylphenyl)-4-methylbenzenecarbothioamide
SYSTEMATIC NAME: N-(4-cyclohexylphenyl)-4-methyl-benzenecarbothioamide
MOLECULAR FORMULA: C20H23NS
MOLECULAR WEIGHT: 309.46832
SMILES: CC1=CC=C(C=C1)C(=S)NC2=CC=C(C=C2)C3CCCCC3
Structure:

CAS RN: 147701-85-7
CAS Name: N-(4-cyclohexylphenyl)benzenecarbothioamide
OPENEYE Name: N-(4-cyclohexylphenyl)benzenecarbothioamide
IUPAC Name: N-(4-cyclohexylphenyl)benzenecarbothioamide
SYSTEMATIC NAME: N-(4-cyclohexylphenyl)benzenecarbothioamide
MOLECULAR FORMULA: C19H21NS
MOLECULAR WEIGHT: 295.44174
SMILES: C1CCC(CC1)C2=CC=C(C=C2)NC(=S)C3=CC=CC=C3
Structure:

CAS RN: 910-86-1
CAS Name: 1,3-bis[4-(3-methylbutoxy)phenyl]thiourea
OPENEYE Name: 1,3-bis(4-isopentyloxyphenyl)thiourea
IUPAC Name: 1,3-bis[4-(3-methylbutoxy)phenyl]thiourea
SYSTEMATIC NAME: 1,3-bis[4-(3-methylbutoxy)phenyl]thiourea
MOLECULAR FORMULA: C23H32N2O2S
MOLECULAR WEIGHT: 400.57738
SMILES: CC(C)CCOC1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)OCCC(C)C
Structure:

CAS RN: 67-16-3
CAS Name: N-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-N-[(E)-3-[[(E)-2-[(4-amino-2-methyl-5-pyrimidinyl)methyl-formylamino]-5-hydroxypent-2-en-3-yl]disulfanyl]-5-hydroxypent-2-en-2-yl]formamide
OPENEYE Name: N-[(4-amino-2-methyl-pyrimidin-5-yl)methyl]-N-[(E)-2-[[(E)-2-[(4-amino-2-methyl-pyrimidin-5-yl)methyl-formyl-amino]-1-(2-hydroxyethyl)prop-1-enyl]disulfanyl]-4-hydroxy-1-methyl-but-1-enyl]formamide
IUPAC Name: N-[(4-amino-2-methylpyrimidin-5-yl)methyl]-N-[(E)-3-[[(E)-2-[(4-amino-2-methylpyrimidin-5-yl)methyl-formylamino]-5-hydroxypent-2-en-3-yl]disulfanyl]-5-hydroxypent-2-en-2-yl]formamide
SYSTEMATIC NAME: N-[(4-azanyl-2-methyl-pyrimidin-5-yl)methyl]-N-[(E)-3-[[(E)-2-[(4-azanyl-2-methyl-pyrimidin-5-yl)methyl-methanoyl-amino]-5-oxidanyl-pent-2-en-3-yl]disulfanyl]-5-oxidanyl-pent-2-en-2-yl]methanamide
MOLECULAR FORMULA: C24H34N8O4S2
MOLECULAR WEIGHT: 562.70796
SMILES: CC1=NC=C(C(=N1)N)CN(/C(=C(/SS/C(=C(/N(C=O)CC2=CN=C(N=C2N)C)\C)/CCO)\CCO)/C)C=O
Structure:

CAS RN: 162929-97-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C15H18ClN3S
MOLECULAR WEIGHT: 307.84152
SMILES: CC(=CCN1CCN2C3=C(C=C(C=C3C1)Cl)NC2=S)C
Structure:

CAS RN: 3438-72-0
CAS Name: 3-(phenylmethyl)-2-sulfanylidene-5,6-dihydro-1H-imidazo[4,5-d]pyridazine-4,7-dione
OPENEYE Name: 3-benzyl-2-thioxo-5,6-dihydro-1H-imidazo[4,5-d]pyridazine-4,7-dione
IUPAC Name: 3-benzyl-2-sulfanylidene-5,6-dihydro-1H-imidazo[4,5-d]pyridazine-4,7-dione
SYSTEMATIC NAME: 3-(phenylmethyl)-2-sulfanylidene-5,6-dihydro-1H-imidazo[4,5-d]pyridazine-4,7-dione
MOLECULAR FORMULA: C12H10N4O2S
MOLECULAR WEIGHT: 274.2984
SMILES: C1=CC=C(C=C1)CN2C3=C(C(=O)NNC3=O)NC2=S
Structure:

CAS RN: 63886-80-6
CAS Name: 3-phenyl-2-sulfanylidene-3a,7a-dihydro-1H-imidazo[4,5-d]pyridazine-4,7-dione
OPENEYE Name: 3-phenyl-2-thioxo-3a,7a-dihydro-1H-imidazo[4,5-d]pyridazine-4,7-dione
IUPAC Name: 3-phenyl-2-sulfanylidene-3a,7a-dihydro-1H-imidazo[4,5-d]pyridazine-4,7-dione
SYSTEMATIC NAME: 3-phenyl-2-sulfanylidene-3a,7a-dihydro-1H-imidazo[4,5-d]pyridazine-4,7-dione
MOLECULAR FORMULA: C11H8N4O2S
MOLECULAR WEIGHT: 260.27182
SMILES: C1=CC=C(C=C1)N2C3C(C(=O)N=NC3=O)NC2=S
Structure:

CAS RN: 461443-59-4
CAS Name: 4-[4-[[(9R)-11-butyl-9-[(R)-cyclohexyl(hydroxy)methyl]-7,10-dioxo-3,8,11-triazaspiro[5.5]undecan-3-yl]methyl]phenoxy]benzoic acid
OPENEYE Name: 4-[4-[[(9R)-11-butyl-9-[(R)-cyclohexyl(hydroxy)methyl]-7,10-dioxo-3,8,11-triazaspiro[5.5]undecan-3-yl]methyl]phenoxy]benzoic acid
IUPAC Name: 4-[4-[[(9R)-11-butyl-9-[(R)-cyclohexyl(hydroxy)methyl]-7,10-dioxo-3,8,11-triazaspiro[5.5]undecan-3-yl]methyl]phenoxy]benzoic acid
SYSTEMATIC NAME: 4-[4-[[(9R)-11-butyl-9-[(R)-cyclohexyl(oxidanyl)methyl]-7,10-bis(oxidanylidene)-3,8,11-triazaspiro[5.5]undecan-3-yl]methyl]phenoxy]benzoic acid
MOLECULAR FORMULA: C33H43N3O6
MOLECULAR WEIGHT: 577.71102
SMILES: CCCCN1C(=O)[C@H](NC(=O)C12CCN(CC2)CC3=CC=C(C=C3)OC4=CC=C(C=C4)C(=O)O)[C@@H](C5CCCCC5)O
Structure:

CAS RN: 461023-63-2
CAS Name: 4-[4-[[(9R)-11-butyl-9-[(R)-cyclohexyl(hydroxy)methyl]-7,10-dioxo-3,8,11-triazaspiro[5.5]undecan-3-yl]methyl]phenoxy]benzoic acid
OPENEYE Name: 4-[4-[[(9R)-11-butyl-9-[(R)-cyclohexyl(hydroxy)methyl]-7,10-dioxo-3,8,11-triazaspiro[5.5]undecan-3-yl]methyl]phenoxy]benzoic acid
IUPAC Name: 4-[4-[[(9R)-11-butyl-9-[(R)-cyclohexyl(hydroxy)methyl]-7,10-dioxo-3,8,11-triazaspiro[5.5]undecan-3-yl]methyl]phenoxy]benzoic acid
SYSTEMATIC NAME: 4-[4-[[(9R)-11-butyl-9-[(R)-cyclohexyl(oxidanyl)methyl]-7,10-bis(oxidanylidene)-3,8,11-triazaspiro[5.5]undecan-3-yl]methyl]phenoxy]benzoic acid
MOLECULAR FORMULA: C33H43N3O6
MOLECULAR WEIGHT: 577.71102
SMILES: CCCCN1C(=O)[C@H](NC(=O)C12CCN(CC2)CC3=CC=C(C=C3)OC4=CC=C(C=C4)C(=O)O)[C@@H](C5CCCCC5)O
Structure:

CAS RN: 674782-28-6
CAS Name: 4-[4-[[(9R)-11-butyl-9-[(R)-cyclohexyl(hydroxy)methyl]-7,10-dioxo-3,8,11-triazaspiro[5.5]undecan-3-yl]methyl]phenoxy]benzoic acid
OPENEYE Name: 4-[4-[[(9R)-11-butyl-9-[(R)-cyclohexyl(hydroxy)methyl]-7,10-dioxo-3,8,11-triazaspiro[5.5]undecan-3-yl]methyl]phenoxy]benzoic acid
IUPAC Name: 4-[4-[[(9R)-11-butyl-9-[(R)-cyclohexyl(hydroxy)methyl]-7,10-dioxo-3,8,11-triazaspiro[5.5]undecan-3-yl]methyl]phenoxy]benzoic acid
SYSTEMATIC NAME: 4-[4-[[(9R)-11-butyl-9-[(R)-cyclohexyl(oxidanyl)methyl]-7,10-bis(oxidanylidene)-3,8,11-triazaspiro[5.5]undecan-3-yl]methyl]phenoxy]benzoic acid
MOLECULAR FORMULA: C33H43N3O6
MOLECULAR WEIGHT: 577.71102
SMILES: CCCCN1C(=O)[C@H](NC(=O)C12CCN(CC2)CC3=CC=C(C=C3)OC4=CC=C(C=C4)C(=O)O)[C@@H](C5CCCCC5)O
Structure:

CAS RN: 675184-11-9
CAS Name: 4-[4-[[(9R)-11-butyl-9-[(R)-cyclohexyl(hydroxy)methyl]-7,10-dioxo-3,8,11-triazaspiro[5.5]undecan-3-yl]methyl]phenoxy]benzoic acid
OPENEYE Name: 4-[4-[[(9R)-11-butyl-9-[(R)-cyclohexyl(hydroxy)methyl]-7,10-dioxo-3,8,11-triazaspiro[5.5]undecan-3-yl]methyl]phenoxy]benzoic acid
IUPAC Name: 4-[4-[[(9R)-11-butyl-9-[(R)-cyclohexyl(hydroxy)methyl]-7,10-dioxo-3,8,11-triazaspiro[5.5]undecan-3-yl]methyl]phenoxy]benzoic acid
SYSTEMATIC NAME: 4-[4-[[(9R)-11-butyl-9-[(R)-cyclohexyl(oxidanyl)methyl]-7,10-bis(oxidanylidene)-3,8,11-triazaspiro[5.5]undecan-3-yl]methyl]phenoxy]benzoic acid
MOLECULAR FORMULA: C33H43N3O6
MOLECULAR WEIGHT: 577.71102
SMILES: CCCCN1C(=O)[C@H](NC(=O)C12CCN(CC2)CC3=CC=C(C=C3)OC4=CC=C(C=C4)C(=O)O)[C@@H](C5CCCCC5)O
Structure:

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