4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(1-methylbenzimidazol-2-yl)thiophene-2-carboxamide

Systemtic Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(1-methylbenzimidazol-2-yl)thiophene-2-carboxamide Openeye Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(1-methylbenzimidazol-2-yl)thiophene-2-carboxamide CAS Name: 4-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-N-(1-methyl-2-benzimidazolyl)-2-thiophenecarboxamide IUPAC Name: 4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-N-(1-methylbenzimidazol-2-yl)thiophene-2-carboxamide Traditional Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(1-methylbenzimidazol-2-yl)thiophene-2-carboxamide Formula: C19H18N6O3S MolecularWeight: 410.44962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CSC(=C2)C(=O)NC3=NC4=CC=CC=C4N3C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CSC(=C2)C(=O)NC3=NC4=CC=CC=C4N3C)C)[N+](=O)[O-]

InChI

InChI=1S/C19H18N6O3S/c1-11-17(25(27)28)12(2)24(22-11)9-13-8-16(29-10-13)18(26)21-19-20-14-6-4-5-7-15(14)23(19)3/h4-8,10H,9H2,1-3H3,(H,20,21,26)