4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitro-N-(1-propylbenzimidazol-2-yl)benzamide

Systemtic Name: 4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitro-N-(1-propylbenzimidazol-2-yl)benzamide Openeye Name: 4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitro-N-(1-propylbenzimidazol-2-yl)benzamide CAS Name: 4-[(4-methyl-1,2,4-triazol-3-yl)thio]-3-nitro-N-(1-propyl-2-benzimidazolyl)benzamide IUPAC Name: 4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitro-N-(1-propylbenzimidazol-2-yl)benzamide Traditional Name: 4-[(4-methyl-1,2,4-triazol-3-yl)thio]-3-nitro-N-(1-propylbenzimidazol-2-yl)benzamide Formula: C20H19N7O3S MolecularWeight: 437.47496

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2N=C1NC(=O)C3=CC(=C(C=C3)SC4=NN=CN4C)[N+](=O)[O-]

Isomeric SMILES

CCCN1C2=CC=CC=C2N=C1NC(=O)C3=CC(=C(C=C3)SC4=NN=CN4C)[N+](=O)[O-]

InChI

InChI=1S/C20H19N7O3S/c1-3-10-26-15-7-5-4-6-14(15)22-19(26)23-18(28)13-8-9-17(16(11-13)27(29)30)31-20-24-21-12-25(20)2/h4-9,11-12H,3,10H2,1-2H3,(H,22,23,28)