N-(1H-benzimidazol-2-yl)-4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitro-benzamide

Systemtic Name: N-(1H-benzimidazol-2-yl)-4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitro-benzamide Openeye Name: N-(1H-benzimidazol-2-yl)-4-(4-methylthiazol-2-yl)sulfanyl-3-nitro-benzamide CAS Name: N-(1H-benzimidazol-2-yl)-4-[(4-methyl-2-thiazolyl)thio]-3-nitrobenzamide IUPAC Name: N-(1H-benzimidazol-2-yl)-4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitrobenzamide Traditional Name: N-(1H-benzimidazol-2-yl)-4-[(4-methylthiazol-2-yl)thio]-3-nitro-benzamide Formula: C18H13N5O3S2 MolecularWeight: 411.45752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)SC2=C(C=C(C=C2)C(=O)NC3=NC4=CC=CC=C4N3)[N+](=O)[O-]

Isomeric SMILES

CC1=CSC(=N1)SC2=C(C=C(C=C2)C(=O)NC3=NC4=CC=CC=C4N3)[N+](=O)[O-]

InChI

InChI=1S/C18H13N5O3S2/c1-10-9-27-18(19-10)28-15-7-6-11(8-14(15)23(25)26)16(24)22-17-20-12-4-2-3-5-13(12)21-17/h2-9H,1H3,(H2,20,21,22,24)