Saturday, June 23, 2012

http://ChemLookup.com Compounds




CAS RN: 61057-97-4
CAS Name: N-cyclohexylcyclohexanamine; 2-(diphenylphosphinothioylamino)-3-phenylpropanoic acid
OPENEYE Name: N-cyclohexylcyclohexanamine; 2-(diphenylphosphinothioylamino)-3-phenyl-propanoic acid
IUPAC Name: N-cyclohexylcyclohexanamine; 2-(diphenylphosphinothioylamino)-3-phenylpropanoic acid
SYSTEMATIC NAME: N-cyclohexylcyclohexanamine; 2-(diphenylphosphinothioylamino)-3-phenyl-propanoic acid
MOLECULAR FORMULA: C33H43N2O2PS
MOLECULAR WEIGHT: 562.745481
SMILES: C1CCC(CC1)NC2CCCCC2.C1=CC=C(C=C1)CC(C(=O)O)NP(=S)(C2=CC=CC=C2)C3=CC=CC=C3
Structure:

CAS RN: 61057-93-0
CAS Name: N-cyclohexylcyclohexanamine; 2-(diphenylphosphinothioylamino)-4-methylpentanoic acid
OPENEYE Name: N-cyclohexylcyclohexanamine; 2-(diphenylphosphinothioylamino)-4-methyl-pentanoic acid
IUPAC Name: N-cyclohexylcyclohexanamine; 2-(diphenylphosphinothioylamino)-4-methylpentanoic acid
SYSTEMATIC NAME: N-cyclohexylcyclohexanamine; 2-(diphenylphosphinothioylamino)-4-methyl-pentanoic acid
MOLECULAR FORMULA: C30H45N2O2PS
MOLECULAR WEIGHT: 528.729261
SMILES: CC(C)CC(C(=O)O)NP(=S)(C1=CC=CC=C1)C2=CC=CC=C2.C1CCC(CC1)NC2CCCCC2
Structure:

CAS RN: 60875-31-2
CAS Name: 1-[(3-hydroxy-4,5-dimethyl-2-thiazolylidene)hydrazinylidene]-2-naphthalenone
OPENEYE Name: 1-[(3-hydroxy-4,5-dimethyl-thiazol-2-ylidene)hydrazono]naphthalen-2-one
IUPAC Name: 1-[(3-hydroxy-4,5-dimethyl-1,3-thiazol-2-ylidene)hydrazinylidene]naphthalen-2-one
SYSTEMATIC NAME: 1-[(4,5-dimethyl-3-oxidanyl-1,3-thiazol-2-ylidene)hydrazinylidene]naphthalen-2-one
MOLECULAR FORMULA: C15H13N3O2S
MOLECULAR WEIGHT: 299.34762
SMILES: CC1=C(SC(=NN=C2C(=O)C=CC3=CC=CC=C32)N1O)C
Structure:

CAS RN: 60875-30-1
CAS Name: 4-[(4,5-dimethyl-3-oxido-2-thiazol-3-iumyl)azo]-N,N-dimethylaniline
OPENEYE Name: 4-(4,5-dimethyl-3-oxido-thiazol-3-ium-2-yl)azo-N,N-dimethyl-aniline
IUPAC Name: 4-[(4,5-dimethyl-3-oxido-1,3-thiazol-3-ium-2-yl)diazenyl]-N,N-dimethylaniline
SYSTEMATIC NAME: 4-[(4,5-dimethyl-3-oxidanidyl-1,3-thiazol-3-ium-2-yl)diazenyl]-N,N-dimethyl-aniline
MOLECULAR FORMULA: C13H16N4OS
MOLECULAR WEIGHT: 276.35734
SMILES: CC1=C(SC(=[N+]1[O-])N=NC2=CC=C(C=C2)N(C)C)C
Structure:

CAS RN: 60875-29-8
CAS Name: N,N-dimethyl-4-[(4-methyl-3-oxido-2-thiazol-3-iumyl)azo]aniline
OPENEYE Name: N,N-dimethyl-4-(4-methyl-3-oxido-thiazol-3-ium-2-yl)azo-aniline
IUPAC Name: N,N-dimethyl-4-[(4-methyl-3-oxido-1,3-thiazol-3-ium-2-yl)diazenyl]aniline
SYSTEMATIC NAME: N,N-dimethyl-4-[(4-methyl-3-oxidanidyl-1,3-thiazol-3-ium-2-yl)diazenyl]aniline
MOLECULAR FORMULA: C12H14N4OS
MOLECULAR WEIGHT: 262.33076
SMILES: CC1=CSC(=[N+]1[O-])N=NC2=CC=C(C=C2)N(C)C
Structure:

CAS RN: 60875-28-7
CAS Name: 4-[(3-hydroxy-4-methyl-2-thiazolylidene)hydrazinylidene]-1-cyclohexa-2,5-dienone
OPENEYE Name: 4-[(3-hydroxy-4-methyl-thiazol-2-ylidene)hydrazono]cyclohexa-2,5-dien-1-one
IUPAC Name: 4-[(3-hydroxy-4-methyl-1,3-thiazol-2-ylidene)hydrazinylidene]cyclohexa-2,5-dien-1-one
SYSTEMATIC NAME: 4-[(4-methyl-3-oxidanyl-1,3-thiazol-2-ylidene)hydrazinylidene]cyclohexa-2,5-dien-1-one
MOLECULAR FORMULA: C10H9N3O2S
MOLECULAR WEIGHT: 235.26236
SMILES: CC1=CSC(=NN=C2C=CC(=O)C=C2)N1O
Structure:

CAS RN: 60973-50-4
CAS Name: benzoic acid 6,7-dihydro-5H-1,4-dithiepin-6-yl ester
OPENEYE Name: 6,7-dihydro-5H-1,4-dithiepin-6-yl benzoate
IUPAC Name: 6,7-dihydro-5H-1,4-dithiepin-6-yl benzoate
SYSTEMATIC NAME: 6,7-dihydro-5H-1,4-dithiepin-6-yl benzoate
MOLECULAR FORMULA: C12H12O2S2
MOLECULAR WEIGHT: 252.35248
SMILES: C1C(CSC=CS1)OC(=O)C2=CC=CC=C2
Structure:

CAS RN: 64088-76-2
CAS Name: 2-[[[4-[(2-amino-4-oxo-1H-quinazolin-6-yl)methoxy]phenyl]-oxomethyl]amino]pentanedioic acid
OPENEYE Name: 2-[[4-[(2-amino-4-oxo-1H-quinazolin-6-yl)methoxy]benzoyl]amino]pentanedioic acid
IUPAC Name: 2-[[4-[(2-amino-4-oxo-1H-quinazolin-6-yl)methoxy]benzoyl]amino]pentanedioic acid
SYSTEMATIC NAME: 2-[[4-[(2-azanyl-4-oxidanylidene-1H-quinazolin-6-yl)methoxy]phenyl]carbonylamino]pentanedioic acid
MOLECULAR FORMULA: C21H20N4O7
MOLECULAR WEIGHT: 440.4061
SMILES: C1=CC(=CC=C1C(=O)NC(CCC(=O)O)C(=O)O)OCC2=CC3=C(C=C2)NC(=NC3=O)N
Structure:

CAS RN: 66051-54-5
CAS Name: N-[3-[[4-[(3-amino-3-oxopropyl)amino]-4-oxobutyl]amino]-3-oxopropyl]carbamic acid (phenylmethyl) ester
OPENEYE Name: benzyl N-[3-[[4-[(3-amino-3-oxo-propyl)amino]-4-oxo-butyl]amino]-3-oxo-propyl]carbamate
IUPAC Name: benzyl N-[3-[[4-[(3-amino-3-oxopropyl)amino]-4-oxobutyl]amino]-3-oxopropyl]carbamate
SYSTEMATIC NAME: (phenylmethyl) N-[3-[[4-[(3-azanyl-3-oxidanylidene-propyl)amino]-4-oxidanylidene-butyl]amino]-3-oxidanylidene-propyl]carbamate
MOLECULAR FORMULA: C18H26N4O5
MOLECULAR WEIGHT: 378.42284
SMILES: C1=CC=C(C=C1)COC(=O)NCCC(=O)NCCCC(=O)NCCC(=O)N
Structure:

CAS RN: 72988-03-5
CAS Name: 2-[[[4-[[2-amino-5-[(2-chloroethylamino)-oxomethyl]-4-oxo-1,6,7,8-tetrahydropteridin-6-yl]methylamino]phenyl]-oxomethyl]amino]pentanedioic acid
OPENEYE Name: 2-[[4-[[2-amino-5-(2-chloroethylcarbamoyl)-4-oxo-1,6,7,8-tetrahydropteridin-6-yl]methylamino]benzoyl]amino]pentanedioic acid
IUPAC Name: 2-[[4-[[2-amino-5-(2-chloroethylcarbamoyl)-4-oxo-1,6,7,8-tetrahydropteridin-6-yl]methylamino]benzoyl]amino]pentanedioic acid
SYSTEMATIC NAME: 2-[[4-[[2-azanyl-5-(2-chloroethylcarbamoyl)-4-oxidanylidene-1,6,7,8-tetrahydropteridin-6-yl]methylamino]phenyl]carbonylamino]pentanedioic acid
MOLECULAR FORMULA: C22H27ClN8O7
MOLECULAR WEIGHT: 550.95218
SMILES: C1C(N(C2=C(N1)NC(=NC2=O)N)C(=O)NCCCl)CNC3=CC=C(C=C3)C(=O)NC(CCC(=O)O)C(=O)O
Structure:

CAS RN: 70280-75-0
CAS Name: 2-[[[4-[(2,4-diamino-6-pteridinyl)methyl-ethylamino]phenyl]-oxomethyl]amino]pentanedioic acid diethyl ester
OPENEYE Name: diethyl 2-[[4-[(2,4-diaminopteridin-6-yl)methyl-ethyl-amino]benzoyl]amino]pentanedioate
IUPAC Name: diethyl 2-[[4-[(2,4-diaminopteridin-6-yl)methyl-ethylamino]benzoyl]amino]pentanedioate
SYSTEMATIC NAME: diethyl 2-[[4-[[2,4-bis(azanyl)pteridin-6-yl]methyl-ethyl-amino]phenyl]carbonylamino]pentanedioate
MOLECULAR FORMULA: C25H32N8O5
MOLECULAR WEIGHT: 524.57218
SMILES: CCN(CC1=CN=C2C(=N1)C(=NC(=N2)N)N)C3=CC=C(C=C3)C(=O)NC(CCC(=O)OCC)C(=O)OCC
Structure:

CAS RN: 71120-19-9
CAS Name: 1-[5-(4-amino-2-oxo-1-pyrimidinyl)-4-hydroxy-2-(hydroxymethyl)-3-oxolanyl]-3-methylurea
OPENEYE Name: 1-[5-(4-amino-2-oxo-pyrimidin-1-yl)-4-hydroxy-2-(hydroxymethyl)tetrahydrofuran-3-yl]-3-methyl-urea
IUPAC Name: 1-[5-(4-amino-2-oxopyrimidin-1-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]-3-methylurea
SYSTEMATIC NAME: 1-[5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-2-(hydroxymethyl)-4-oxidanyl-oxolan-3-yl]-3-methyl-urea
MOLECULAR FORMULA: C11H17N5O5
MOLECULAR WEIGHT: 299.28318
SMILES: CNC(=O)NC1C(OC(C1O)N2C=CC(=NC2=O)N)CO
Structure:

CAS RN: 67318-05-2
CAS Name: 2-[(3-cyano-4,5-dimethyl-2-furanyl)amino]-2-oxoacetic acid
OPENEYE Name: 2-[(3-cyano-4,5-dimethyl-2-furyl)amino]-2-oxo-acetic acid
IUPAC Name: 2-[(3-cyano-4,5-dimethylfuran-2-yl)amino]-2-oxoacetic acid
SYSTEMATIC NAME: 2-[(3-cyano-4,5-dimethyl-furan-2-yl)amino]-2-oxidanylidene-ethanoic acid
MOLECULAR FORMULA: C9H8N2O4
MOLECULAR WEIGHT: 208.17082
SMILES: CC1=C(OC(=C1C#N)NC(=O)C(=O)O)C
Structure:

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