Monday, May 28, 2012

http://ChemLookup.com Compounds




CAS RN: 13264-13-6
CAS Name: N2,N2',N4,N4',N6,N6'-hexakis-phenyl-1,3,5-triaza-2$l^{5},4$l^{5},6$l^{5}-triphosphacyclohexa-1,3,5-triene-2,2,4,4,6,6-hexamine
OPENEYE Name: N2,N2',N4,N4',N6,N6'-hexakis-phenyl-1,3,5-triaza-2$l^{5},4$l^{5},6$l^{5}-triphosphacyclohexa-1,3,5-triene-2,2,4,4,6,6-hexamine
IUPAC Name: 2-N,2-N',4-N,4-N',6-N,6-N'-hexakis-phenyl-1,3,5-triaza-2$l^{5},4$l^{5},6$l^{5}-triphosphacyclohexa-1,3,5-triene-2,2,4,4,6,6-hexamine
SYSTEMATIC NAME: N2,N2',N4,N4',N6,N6'-hexakis-phenyl-1,3,5-triaza-2$l^{5},4$l^{5},6$l^{5}-triphosphacyclohexa-1,3,5-triene-2,2,4,4,6,6-hexamine
MOLECULAR FORMULA: C36H36N9P3
MOLECULAR WEIGHT: 687.652623
SMILES: C1=CC=C(C=C1)NP2(=NP(=NP(=N2)(NC3=CC=CC=C3)NC4=CC=CC=C4)(NC5=CC=CC=C5)NC6=CC=CC=C6)NC7=CC=CC=C7
Structure:

CAS RN: 362-03-8
CAS Name: 3-(10-phenothiazinyl)propanoic acid
OPENEYE Name: 3-phenothiazin-10-ylpropanoic acid
IUPAC Name: 3-phenothiazin-10-ylpropanoic acid
SYSTEMATIC NAME: 3-phenothiazin-10-ylpropanoic acid
MOLECULAR FORMULA: C15H13NO2S
MOLECULAR WEIGHT: 271.33422
SMILES: C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)CCC(=O)O
Structure:

CAS RN: 7046-84-6
CAS Name: 2-(10-phenothiazinyl)ethanol
OPENEYE Name: 2-phenothiazin-10-ylethanol
IUPAC Name: 2-phenothiazin-10-ylethanol
SYSTEMATIC NAME: 2-phenothiazin-10-ylethanol
MOLECULAR FORMULA: C14H13NOS
MOLECULAR WEIGHT: 243.32412
SMILES: C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)CCO
Structure:

CAS RN: 10220-22-1
CAS Name: 1-(4-nitrophenyl)pyrrolidine
OPENEYE Name: 1-(4-nitrophenyl)pyrrolidine
IUPAC Name: 1-(4-nitrophenyl)pyrrolidine
SYSTEMATIC NAME: 1-(4-nitrophenyl)pyrrolidine
MOLECULAR FORMULA: C10H12N2O2
MOLECULAR WEIGHT: 192.21448
SMILES: C1CCN(C1)C2=CC=C(C=C2)[N+](=O)[O-]
Structure:

CAS RN: 2766-42-9
CAS Name: N-(1-hydrazinyl-3-hydroxy-1-oxopropan-2-yl)carbamic acid tert-butyl ester
OPENEYE Name: tert-butyl N-[2-hydrazino-1-(hydroxymethyl)-2-oxo-ethyl]carbamate
IUPAC Name: tert-butyl N-(1-hydrazinyl-3-hydroxy-1-oxopropan-2-yl)carbamate
SYSTEMATIC NAME: tert-butyl N-(1-diazanyl-3-oxidanyl-1-oxidanylidene-propan-2-yl)carbamate
MOLECULAR FORMULA: C8H17N3O4
MOLECULAR WEIGHT: 219.23828
SMILES: CC(C)(C)OC(=O)NC(CO)C(=O)NN
Structure:

CAS RN: 14949-01-0
CAS Name: 2-chloro-N-(4-sulfamoylphenyl)acetamide
OPENEYE Name: 2-chloro-N-(4-sulfamoylphenyl)acetamide
IUPAC Name: 2-chloro-N-(4-sulfamoylphenyl)acetamide
SYSTEMATIC NAME: 2-chloranyl-N-(4-sulfamoylphenyl)ethanamide
MOLECULAR FORMULA: C8H9ClN2O3S
MOLECULAR WEIGHT: 248.68666
SMILES: C1=CC(=CC=C1NC(=O)CCl)S(=O)(=O)N
Structure:

CAS RN: 83473-10-3
CAS Name: 2-chloro-N-(2-methyl-4-nitrophenyl)acetamide
OPENEYE Name: 2-chloro-N-(2-methyl-4-nitro-phenyl)acetamide
IUPAC Name: 2-chloro-N-(2-methyl-4-nitrophenyl)acetamide
SYSTEMATIC NAME: 2-chloranyl-N-(2-methyl-4-nitro-phenyl)ethanamide
MOLECULAR FORMULA: C9H9ClN2O3
MOLECULAR WEIGHT: 228.63236
SMILES: CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CCl
Structure:

CAS RN: 97-14-3
CAS Name: 2-acetamido-3-hydroxypropanoic acid
OPENEYE Name: 2-acetamido-3-hydroxy-propanoic acid
IUPAC Name: 2-acetamido-3-hydroxypropanoic acid
SYSTEMATIC NAME: 2-acetamido-3-oxidanyl-propanoic acid
MOLECULAR FORMULA: C5H9NO4
MOLECULAR WEIGHT: 147.12926
SMILES: CC(=O)NC(CO)C(=O)O
Structure:

CAS RN: 2123-00-4
CAS Name: 3-[(2,4-dinitrophenyl)hydrazinylidene]-10,13,17-trimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-ol
OPENEYE Name: 3-[(2,4-dinitrophenyl)hydrazono]-10,13,17-trimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-ol
IUPAC Name: 3-[(2,4-dinitrophenyl)hydrazinylidene]-10,13,17-trimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-ol
SYSTEMATIC NAME: 3-[(2,4-dinitrophenyl)hydrazinylidene]-10,13,17-trimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-ol
MOLECULAR FORMULA: C26H34N4O5
MOLECULAR WEIGHT: 482.57196
SMILES: CC12CCC(=NNC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])C=C1CCC4C2CCC5(C4CCC5(C)O)C
Structure:

CAS RN: 20535-20-0
CAS Name: 1-[4-amino-3-hydroxy-5-(hydroxymethyl)-2-oxolanyl]pyrimidine-2,4-dione
OPENEYE Name: 1-[4-amino-3-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidine-2,4-dione
IUPAC Name: 1-[4-amino-3-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione
SYSTEMATIC NAME: 1-[4-azanyl-5-(hydroxymethyl)-3-oxidanyl-oxolan-2-yl]pyrimidine-2,4-dione
MOLECULAR FORMULA: C9H13N3O5
MOLECULAR WEIGHT: 243.21662
SMILES: C1=CN(C(=O)NC1=O)C2C(C(C(O2)CO)N)O
Structure:

CAS RN: 62442-52-8
CAS Name: 1,5-diphenyl-1,2,5,6-tetrahydro-[1,2,4]triazolo[1,2-a][1,2,4]triazole-3,7-dione
OPENEYE Name: 1,5-diphenyl-1,2,5,6-tetrahydro-[1,2,4]triazolo[1,2-a][1,2,4]triazole-3,7-dione
IUPAC Name: 1,5-diphenyl-1,2,5,6-tetrahydro-[1,2,4]triazolo[1,2-a][1,2,4]triazole-3,7-dione
SYSTEMATIC NAME: 1,5-diphenyl-1,2,5,6-tetrahydro-[1,2,4]triazolo[1,2-a][1,2,4]triazole-3,7-dione
MOLECULAR FORMULA: C16H14N4O2
MOLECULAR WEIGHT: 294.30796
SMILES: C1=CC=C(C=C1)C2NC(=O)N3N2C(=O)NC3C4=CC=CC=C4
Structure:

CAS RN: 89792-42-7
CAS Name: 6-methyl-2,1,3-benzothiadiazol-4-amine
OPENEYE Name: 6-methyl-2,1,3-benzothiadiazol-4-amine
IUPAC Name: 6-methyl-2,1,3-benzothiadiazol-4-amine
SYSTEMATIC NAME: 6-methyl-2,1,3-benzothiadiazol-4-amine
MOLECULAR FORMULA: C7H7N3S
MOLECULAR WEIGHT: 165.21558
SMILES: CC1=CC2=NSN=C2C(=C1)N
Structure:

CAS RN: 67014-36-2
CAS Name: 5-amino-6-methyl-1,3-dihydrobenzimidazol-2-one
OPENEYE Name: 5-amino-6-methyl-1,3-dihydrobenzimidazol-2-one
IUPAC Name: 5-amino-6-methyl-1,3-dihydrobenzimidazol-2-one
SYSTEMATIC NAME: 5-azanyl-6-methyl-1,3-dihydrobenzimidazol-2-one
MOLECULAR FORMULA: C8H9N3O
MOLECULAR WEIGHT: 163.17656
SMILES: CC1=CC2=C(C=C1N)NC(=O)N2
Structure:

CAS RN: 70631-15-1
CAS Name: 7-amino-6-nitro-1H-quinazoline-2,4-dione
OPENEYE Name: 7-amino-6-nitro-1H-quinazoline-2,4-dione
IUPAC Name: 7-amino-6-nitro-1H-quinazoline-2,4-dione
SYSTEMATIC NAME: 7-azanyl-6-nitro-1H-quinazoline-2,4-dione
MOLECULAR FORMULA: C8H6N4O4
MOLECULAR WEIGHT: 222.15764
SMILES: C1=C2C(=CC(=C1[N+](=O)[O-])N)NC(=O)NC2=O
Structure:

CAS RN: 76822-66-7
CAS Name: 7-chloro-6-nitro-1H-quinazoline-2,4-dione
OPENEYE Name: 7-chloro-6-nitro-1H-quinazoline-2,4-dione
IUPAC Name: 7-chloro-6-nitro-1H-quinazoline-2,4-dione
SYSTEMATIC NAME: 7-chloranyl-6-nitro-1H-quinazoline-2,4-dione
MOLECULAR FORMULA: C8H4ClN3O4
MOLECULAR WEIGHT: 241.58806
SMILES: C1=C2C(=CC(=C1[N+](=O)[O-])Cl)NC(=O)NC2=O
Structure:

CAS RN: 5255-51-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C20H24O3
MOLECULAR WEIGHT: 312.40276
SMILES: CC12CCC3C(C1CC4C2OC(=O)C4)CCC5=C3C=CC(=C5)O
Structure:

CAS RN: 10459-00-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C21H28O3
MOLECULAR WEIGHT: 328.44522
SMILES: CC12CCC(=O)C=C1CCC3C2CCC4(C3CC5C4OC(=O)C5)C
Structure:

CAS RN: 21383-86-8
CAS Name: 4,8-bis(1-aziridinyl)-2,6-dichloropyrimido[5,4-d]pyrimidine
OPENEYE Name: 4,8-bis(aziridin-1-yl)-2,6-dichloro-pyrimido[5,4-d]pyrimidine
IUPAC Name: 4,8-bis(aziridin-1-yl)-2,6-dichloropyrimido[5,4-d]pyrimidine
SYSTEMATIC NAME: 4,8-bis(aziridin-1-yl)-2,6-bis(chloranyl)pyrimido[5,4-d]pyrimidine
MOLECULAR FORMULA: C10H8Cl2N6
MOLECULAR WEIGHT: 283.11672
SMILES: C1CN1C2=NC(=NC3=C2N=C(N=C3N4CC4)Cl)Cl
Structure:

CAS RN: 21383-85-7
CAS Name: 4,8-bis(1-aziridinyl)-2-chloropyrimido[5,4-d]pyrimidine
OPENEYE Name: 4,8-bis(aziridin-1-yl)-2-chloro-pyrimido[5,4-d]pyrimidine
IUPAC Name: 4,8-bis(aziridin-1-yl)-2-chloropyrimido[5,4-d]pyrimidine
SYSTEMATIC NAME: 4,8-bis(aziridin-1-yl)-2-chloranyl-pyrimido[5,4-d]pyrimidine
MOLECULAR FORMULA: C10H9ClN6
MOLECULAR WEIGHT: 248.67166
SMILES: C1CN1C2=NC(=NC3=C2N=CN=C3N4CC4)Cl
Structure:

CAS RN: 2122-97-6
CAS Name: N-[[17-[1-[(2,4-dinitrophenyl)hydrazinylidene]ethyl]-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-ylidene]amino]-2,4-dinitroaniline
OPENEYE Name: N-[[17-[N-(2,4-dinitroanilino)-C-methyl-carbonimidoyl]-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-ylidene]amino]-2,4-dinitro-aniline
IUPAC Name: N-[[17-[N-(2,4-dinitroanilino)-C-methylcarbonimidoyl]-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-ylidene]amino]-2,4-dinitroaniline
SYSTEMATIC NAME: N-[[17-[N-[(2,4-dinitrophenyl)amino]-C-methyl-carbonimidoyl]-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-ylidene]amino]-2,4-dinitro-aniline
MOLECULAR FORMULA: C33H38N8O8
MOLECULAR WEIGHT: 674.70362
SMILES: CC(=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])C2CCC3C2(CCC4C3CCC5=CC(=NNC6=C(C=C(C=C6)[N+](=O)[O-])[N+](=O)[O-])CCC45C)C
Structure:

CAS RN: 89941-12-8
CAS Name: 2-[nitroso(propan-2-yl)amino]butanoic acid
OPENEYE Name: 2-[isopropyl(nitroso)amino]butanoic acid
IUPAC Name: 2-[nitroso(propan-2-yl)amino]butanoic acid
SYSTEMATIC NAME: 2-[nitroso(propan-2-yl)amino]butanoic acid
MOLECULAR FORMULA: C7H14N2O3
MOLECULAR WEIGHT: 174.19766
SMILES: CCC(C(=O)O)N(C(C)C)N=O
Structure:

CAS RN: 90324-75-7
CAS Name: 2-[amino(ethyl)amino]propanoic acid
OPENEYE Name: 2-[amino(ethyl)amino]propanoic acid
IUPAC Name: 2-[amino(ethyl)amino]propanoic acid
SYSTEMATIC NAME: 2-[azanyl(ethyl)amino]propanoic acid
MOLECULAR FORMULA: C5H12N2O2
MOLECULAR WEIGHT: 132.16098
SMILES: CCN(C(C)C(=O)O)N
Structure:

CAS RN: 42151-75-7
CAS Name: 2-[amino-(phenylmethyl)amino]acetic acid
OPENEYE Name: 2-[amino(benzyl)amino]acetic acid
IUPAC Name: 2-[amino(benzyl)amino]acetic acid
SYSTEMATIC NAME: 2-[azanyl-(phenylmethyl)amino]ethanoic acid
MOLECULAR FORMULA: C9H12N2O2
MOLECULAR WEIGHT: 180.20378
SMILES: C1=CC=C(C=C1)CN(CC(=O)O)N
Structure:

No comments:

Post a Comment