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

Systemtic Name: 4-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]-N-(1-propylbenzimidazol-2-yl)thiophene-2-carboxamide Openeye Name: 4-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]-N-(1-propylbenzimidazol-2-yl)thiophene-2-carboxamide CAS Name: 4-[(5-methyl-3-nitro-1-pyrazolyl)methyl]-N-(1-propyl-2-benzimidazolyl)-2-thiophenecarboxamide IUPAC Name: 4-[(5-methyl-3-nitropyrazol-1-yl)methyl]-N-(1-propylbenzimidazol-2-yl)thiophene-2-carboxamide Traditional Name: 4-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]-N-(1-propylbenzimidazol-2-yl)thiophene-2-carboxamide Formula: C20H20N6O3S MolecularWeight: 424.4762

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2N=C1NC(=O)C3=CC(=CS3)CN4C(=CC(=N4)[N+](=O)[O-])C

Isomeric SMILES

CCCN1C2=CC=CC=C2N=C1NC(=O)C3=CC(=CS3)CN4C(=CC(=N4)[N+](=O)[O-])C

InChI

InChI=1S/C20H20N6O3S/c1-3-8-24-16-7-5-4-6-15(16)21-20(24)22-19(27)17-10-14(12-30-17)11-25-13(2)9-18(23-25)26(28)29/h4-7,9-10,12H,3,8,11H2,1-2H3,(H,21,22,27)