2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-1-(4-nitrophenyl)ethanone

Systemtic Name: 2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-1-(4-nitrophenyl)ethanone Openeye Name: 2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-1-(4-nitrophenyl)ethanone CAS Name: 2-[(6-methyl-1H-benzimidazol-2-yl)thio]-1-(4-nitrophenyl)ethanone IUPAC Name: 2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-1-(4-nitrophenyl)ethanone Traditional Name: 2-[(6-methyl-1H-benzimidazol-2-yl)thio]-1-(4-nitrophenyl)ethanone Formula: C16H13N3O3S MolecularWeight: 327.35772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13N3O3S/c1-10-2-7-13-14(8-10)18-16(17-13)23-9-15(20)11-3-5-12(6-4-11)19(21)22/h2-8H,9H2,1H3,(H,17,18)