4-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-3-nitro-benzamide

Systemtic Name: 4-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-3-nitro-benzamide Openeye Name: 4-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-3-nitro-benzamide CAS Name: 4-[(6-methyl-1H-benzimidazol-2-yl)thio]-3-nitrobenzamide IUPAC Name: 4-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-3-nitrobenzamide Traditional Name: 4-[(6-methyl-1H-benzimidazol-2-yl)thio]-3-nitro-benzamide Formula: C15H12N4O3S MolecularWeight: 328.34578

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)SC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)SC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C15H12N4O3S/c1-8-2-4-10-11(6-8)18-15(17-10)23-13-5-3-9(14(16)20)7-12(13)19(21)22/h2-7H,1H3,(H2,16,20)(H,17,18)