5-[2-[(6-nitro-1H-benzimidazol-2-yl)sulfanyl]ethanoylamino]-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: 5-[2-[(6-nitro-1H-benzimidazol-2-yl)sulfanyl]ethanoylamino]-1-phenyl-pyrazole-4-carboxamide Openeye Name: 5-[[2-[(6-nitro-1H-benzimidazol-2-yl)sulfanyl]acetyl]amino]-1-phenyl-pyrazole-4-carboxamide CAS Name: 5-[[2-[(6-nitro-1H-benzimidazol-2-yl)thio]-1-oxoethyl]amino]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 5-[[2-[(6-nitro-1H-benzimidazol-2-yl)sulfanyl]acetyl]amino]-1-phenylpyrazole-4-carboxamide Traditional Name: 5-[[2-[(6-nitro-1H-benzimidazol-2-yl)thio]acetyl]amino]-1-phenyl-pyrazole-4-carboxamide Formula: C19H15N7O4S MolecularWeight: 437.4319

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=C(C=N2)C(=O)N)NC(=O)CSC3=NC4=C(N3)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C(=C(C=N2)C(=O)N)NC(=O)CSC3=NC4=C(N3)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H15N7O4S/c20-17(28)13-9-21-25(11-4-2-1-3-5-11)18(13)24-16(27)10-31-19-22-14-7-6-12(26(29)30)8-15(14)23-19/h1-9H,10H2,(H2,20,28)(H,22,23)(H,24,27)