Monday, June 25, 2012

http://ChemLookup.com Compounds




CAS RN: 799-07-5
CAS Name: 5-methyl-N,4-bis[(phenylmethylene)amino]-1,2,4-triazol-3-amine
OPENEYE Name: N,4-bis(benzylideneamino)-5-methyl-1,2,4-triazol-3-amine
IUPAC Name: N,4-bis(benzylideneamino)-5-methyl-1,2,4-triazol-3-amine
SYSTEMATIC NAME: 5-methyl-N,4-bis[(phenylmethylidene)amino]-1,2,4-triazol-3-amine
MOLECULAR FORMULA: C17H16N6
MOLECULAR WEIGHT: 304.34914
SMILES: CC1=NN=C(N1N=CC2=CC=CC=C2)NN=CC3=CC=CC=C3
Structure:

CAS RN: 13750-48-6
CAS Name: 3,4-diamino-1H-1,2,4-triazol-5-one
OPENEYE Name: 3,4-diamino-1H-1,2,4-triazol-5-one
IUPAC Name: 3,4-diamino-1H-1,2,4-triazol-5-one
SYSTEMATIC NAME: 3,4-bis(azanyl)-1H-1,2,4-triazol-5-one
MOLECULAR FORMULA: C2H5N5O
MOLECULAR WEIGHT: 115.094
SMILES: C1(=NNC(=O)N1N)N
Structure:

CAS RN: 92765-64-5
CAS Name: (1-methyl-5-tetrazolyl)cyanamide
OPENEYE Name: (1-methyltetrazol-5-yl)cyanamide
IUPAC Name: (1-methyltetrazol-5-yl)cyanamide
SYSTEMATIC NAME: (1-methyl-1,2,3,4-tetrazol-5-yl)cyanamide
MOLECULAR FORMULA: C3H4N6
MOLECULAR WEIGHT: 124.10406
SMILES: CN1C(=NN=N1)NC#N
Structure:

CAS RN: 90980-74-8
CAS Name: (1,4-dimethyl-5-tetrazolylidene)cyanamide
OPENEYE Name: (1,4-dimethyltetrazol-5-ylidene)cyanamide
IUPAC Name: (1,4-dimethyltetrazol-5-ylidene)cyanamide
SYSTEMATIC NAME: (1,4-dimethyl-1,2,3,4-tetrazol-5-ylidene)cyanamide
MOLECULAR FORMULA: C4H6N6
MOLECULAR WEIGHT: 138.13064
SMILES: CN1C(=NC#N)N(N=N1)C
Structure:

CAS RN: 17437-49-9
CAS Name: triphenylphosphoranylideneurea
OPENEYE Name: (triphenyl-$l^{5}-phosphanylidene)urea
IUPAC Name: (triphenyl-$l^{5}-phosphanylidene)urea
SYSTEMATIC NAME: 1-(triphenyl-$l^{5}-phosphanylidene)urea
MOLECULAR FORMULA: C19H17N2OP
MOLECULAR WEIGHT: 320.324841
SMILES: C1=CC=C(C=C1)P(=NC(=O)N)(C2=CC=CC=C2)C3=CC=CC=C3
Structure:

CAS RN: 59772-94-0
CAS Name: 2-tert-butyl-5-tetrazolamine
OPENEYE Name: 2-tert-butyltetrazol-5-amine
IUPAC Name: 2-tert-butyltetrazol-5-amine
SYSTEMATIC NAME: 2-tert-butyl-1,2,3,4-tetrazol-5-amine
MOLECULAR FORMULA: C5H11N5
MOLECULAR WEIGHT: 141.17434
SMILES: CC(C)(C)N1N=C(N=N1)N
Structure:

CAS RN: 59772-93-9
CAS Name: 1-tert-butyl-5-tetrazolamine
OPENEYE Name: 1-tert-butyltetrazol-5-amine
IUPAC Name: 1-tert-butyltetrazol-5-amine
SYSTEMATIC NAME: 1-tert-butyl-1,2,3,4-tetrazol-5-amine
MOLECULAR FORMULA: C5H11N5
MOLECULAR WEIGHT: 141.17434
SMILES: CC(C)(C)N1C(=NN=N1)N
Structure:

CAS RN: 59772-99-5
CAS Name: 1-tert-butyl-5-chlorotetrazole
OPENEYE Name: 1-tert-butyl-5-chloro-tetrazole
IUPAC Name: 1-tert-butyl-5-chlorotetrazole
SYSTEMATIC NAME: 1-tert-butyl-5-chloranyl-1,2,3,4-tetrazole
MOLECULAR FORMULA: C5H9ClN4
MOLECULAR WEIGHT: 160.60476
SMILES: CC(C)(C)N1C(=NN=N1)Cl
Structure:

CAS RN: 1760-37-8
CAS Name: N-[(4-chlorophenyl)methyl]-N-(4,5-dihydro-1H-imidazol-2-ylamino)nitrous amide
OPENEYE Name: N-[(4-chlorophenyl)methyl]-N-(4,5-dihydro-1H-imidazol-2-ylamino)nitrous amide
IUPAC Name: N-[(4-chlorophenyl)methyl]-N-(4,5-dihydro-1H-imidazol-2-ylamino)nitrous amide
SYSTEMATIC NAME: N-[(4-chlorophenyl)methyl]-N-(4,5-dihydro-1H-imidazol-2-ylamino)nitrous amide
MOLECULAR FORMULA: C10H12ClN5O
MOLECULAR WEIGHT: 253.68818
SMILES: C1CN=C(N1)NN(CC2=CC=C(C=C2)Cl)N=O
Structure:

CAS RN: 31127-15-8
CAS Name: [1,3-benzodioxol-5-ylmethyl(nitroso)amino]urea
OPENEYE Name: [1,3-benzodioxol-5-ylmethyl(nitroso)amino]urea
IUPAC Name: [1,3-benzodioxol-5-ylmethyl(nitroso)amino]urea
SYSTEMATIC NAME: 1-[1,3-benzodioxol-5-ylmethyl(nitroso)amino]urea
MOLECULAR FORMULA: C9H10N4O4
MOLECULAR WEIGHT: 238.2001
SMILES: C1OC2=C(O1)C=C(C=C2)CN(NC(=O)N)N=O
Structure:

CAS RN: 3169-54-8
CAS Name: 4-[3-(5-phenyl-2-tetrazolyl)propyl]morpholine
OPENEYE Name: 4-[3-(5-phenyltetrazol-2-yl)propyl]morpholine
IUPAC Name: 4-[3-(5-phenyltetrazol-2-yl)propyl]morpholine
SYSTEMATIC NAME: 4-[3-(5-phenyl-1,2,3,4-tetrazol-2-yl)propyl]morpholine
MOLECULAR FORMULA: C14H19N5O
MOLECULAR WEIGHT: 273.33356
SMILES: C1COCCN1CCCN2N=C(N=N2)C3=CC=CC=C3
Structure:

CAS RN: 23579-47-7
CAS Name: 5-phenyl-2-tetrazolamine
OPENEYE Name: 5-phenyltetrazol-2-amine
IUPAC Name: 5-phenyltetrazol-2-amine
SYSTEMATIC NAME: 5-phenyl-1,2,3,4-tetrazol-2-amine
MOLECULAR FORMULA: C7H7N5
MOLECULAR WEIGHT: 161.16398
SMILES: C1=CC=C(C=C1)C2=NN(N=N2)N
Structure:

CAS RN: 15454-60-1
CAS Name: tetrazole-2,5-diamine
OPENEYE Name: tetrazole-2,5-diamine
IUPAC Name: tetrazole-2,5-diamine
SYSTEMATIC NAME: 1,2,3,4-tetrazole-2,5-diamine
MOLECULAR FORMULA: CH4N6
MOLECULAR WEIGHT: 100.08266
SMILES: C1(=NN(N=N1)N)N
Structure:

CAS RN: 32366-22-6
CAS Name: 2H-tetrazole-5-carboxamide
OPENEYE Name: 2H-tetrazole-5-carboxamide
IUPAC Name: 2H-tetrazole-5-carboxamide
SYSTEMATIC NAME: 2H-1,2,3,4-tetrazole-5-carboxamide
MOLECULAR FORMULA: C2H3N5O
MOLECULAR WEIGHT: 113.07812
SMILES: C1(=NNN=N1)C(=O)N
Structure:

CAS RN: 78697-35-5
CAS Name: 3-(2,3-dihydro-1H-tetrazol-5-yl)-6-(2H-tetrazol-5-yl)-1,2,4,5-tetrazine
OPENEYE Name: 3-(2,3-dihydro-1H-tetrazol-5-yl)-6-(2H-tetrazol-5-yl)-1,2,4,5-tetrazine
IUPAC Name: 3-(2,3-dihydro-1H-tetrazol-5-yl)-6-(2H-tetrazol-5-yl)-1,2,4,5-tetrazine
SYSTEMATIC NAME: 3-(2,3-dihydro-1H-1,2,3,4-tetrazol-5-yl)-6-(2H-1,2,3,4-tetrazol-5-yl)-1,2,4,5-tetrazine
MOLECULAR FORMULA: C4H4N12
MOLECULAR WEIGHT: 220.15496
SMILES: C1(=NNNN1)C2=NN=C(N=N2)C3=NNN=N3
Structure:

CAS RN: 13175-00-3
CAS Name: 2-methyl-5-tetrazolecarboxylic acid
OPENEYE Name: 2-methyltetrazole-5-carboxylic acid
IUPAC Name: 2-methyltetrazole-5-carboxylic acid
SYSTEMATIC NAME: 2-methyl-1,2,3,4-tetrazole-5-carboxylic acid
MOLECULAR FORMULA: C3H4N4O2
MOLECULAR WEIGHT: 128.08946
SMILES: CN1N=C(N=N1)C(=O)O
Structure:

CAS RN: 43131-48-2
CAS Name: 2-methyl-5-(4-nitrophenyl)tetrazole
OPENEYE Name: 2-methyl-5-(4-nitrophenyl)tetrazole
IUPAC Name: 2-methyl-5-(4-nitrophenyl)tetrazole
SYSTEMATIC NAME: 2-methyl-5-(4-nitrophenyl)-1,2,3,4-tetrazole
MOLECULAR FORMULA: C8H7N5O2
MOLECULAR WEIGHT: 205.17348
SMILES: CN1N=C(N=N1)C2=CC=C(C=C2)[N+](=O)[O-]
Structure:

CAS RN: 21743-77-1
CAS Name: 2-(2-methyl-5-tetrazolyl)acetic acid
OPENEYE Name: 2-(2-methyltetrazol-5-yl)acetic acid
IUPAC Name: 2-(2-methyltetrazol-5-yl)acetic acid
SYSTEMATIC NAME: 2-(2-methyl-1,2,3,4-tetrazol-5-yl)ethanoic acid
MOLECULAR FORMULA: C4H6N4O2
MOLECULAR WEIGHT: 142.11604
SMILES: CN1N=C(N=N1)CC(=O)O
Structure:

CAS RN: 21871-47-6
CAS Name: 5-(phenylmethylthio)-2H-tetrazole
OPENEYE Name: 5-benzylsulfanyl-2H-tetrazole
IUPAC Name: 5-benzylsulfanyl-2H-tetrazole
SYSTEMATIC NAME: 5-(phenylmethylsulfanyl)-2H-1,2,3,4-tetrazole
MOLECULAR FORMULA: C8H8N4S
MOLECULAR WEIGHT: 192.24092
SMILES: C1=CC=C(C=C1)CSC2=NNN=N2
Structure:

CAS RN: 27943-07-3
CAS Name: 5-cyclopropyl-2H-tetrazole
OPENEYE Name: 5-cyclopropyl-2H-tetrazole
IUPAC Name: 5-cyclopropyl-2H-tetrazole
SYSTEMATIC NAME: 5-cyclopropyl-2H-1,2,3,4-tetrazole
MOLECULAR FORMULA: C4H6N4
MOLECULAR WEIGHT: 110.11724
SMILES: C1CC1C2=NNN=N2
Structure:

CAS RN: 26670-19-9
CAS Name: 5-(2H-tetrazol-5-ylmethyl)-2H-tetrazole
OPENEYE Name: 5-(2H-tetrazol-5-ylmethyl)-2H-tetrazole
IUPAC Name: 5-(2H-tetrazol-5-ylmethyl)-2H-tetrazole
SYSTEMATIC NAME: 5-(2H-1,2,3,4-tetrazol-5-ylmethyl)-2H-1,2,3,4-tetrazole
MOLECULAR FORMULA: C3H4N8
MOLECULAR WEIGHT: 152.11746
SMILES: C(C1=NNN=N1)C2=NNN=N2
Structure:

CAS RN: 15284-29-4
CAS Name: 2-(5-amino-1-tetrazolyl)ethanol
OPENEYE Name: 2-(5-aminotetrazol-1-yl)ethanol
IUPAC Name: 2-(5-aminotetrazol-1-yl)ethanol
SYSTEMATIC NAME: 2-(5-azanyl-1,2,3,4-tetrazol-1-yl)ethanol
MOLECULAR FORMULA: C3H7N5O
MOLECULAR WEIGHT: 129.12058
SMILES: C(CO)N1C(=NN=N1)N
Structure:

CAS RN: 42371-37-9
CAS Name: 5-bromo-2H-tetrazole
OPENEYE Name: 5-bromo-2H-tetrazole
IUPAC Name: 5-bromo-2H-tetrazole
SYSTEMATIC NAME: 5-bromanyl-2H-1,2,3,4-tetrazole
MOLECULAR FORMULA: CHBrN4
MOLECULAR WEIGHT: 148.94944
SMILES: C1(=NNN=N1)Br
Structure:

CAS RN: 219-60-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C11H6N6
MOLECULAR WEIGHT: 222.20554
SMILES: C1=CC=C2C(=C1)C=CC3=C2N=NC4=NN=NN34
Structure:

CAS RN: 5533-43-7
CAS Name: (1-phenyl-5-tetrazolyl)hydrazine
OPENEYE Name: (1-phenyltetrazol-5-yl)hydrazine
IUPAC Name: (1-phenyltetrazol-5-yl)hydrazine
SYSTEMATIC NAME: (1-phenyl-1,2,3,4-tetrazol-5-yl)diazane
MOLECULAR FORMULA: C7H8N6
MOLECULAR WEIGHT: 176.17862
SMILES: C1=CC=C(C=C1)N2C(=NN=N2)NN
Structure:

CAS RN: 14468-67-8
CAS Name: N-(2-aminophenyl)-1H-benzimidazole-2-carboxamide
OPENEYE Name: N-(2-aminophenyl)-1H-benzimidazole-2-carboxamide
IUPAC Name: N-(2-aminophenyl)-1H-benzimidazole-2-carboxamide
SYSTEMATIC NAME: N-(2-aminophenyl)-1H-benzimidazole-2-carboxamide
MOLECULAR FORMULA: C14H12N4O
MOLECULAR WEIGHT: 252.27128
SMILES: C1=CC=C(C(=C1)N)NC(=O)C2=NC3=CC=CC=C3N2
Structure:

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