6-methoxy-2-(4-methylphenyl)sulfanyl-3-nitro-1H-indole

Systemtic Name: 6-methoxy-2-(4-methylphenyl)sulfanyl-3-nitro-1H-indole Openeye Name: 6-methoxy-3-nitro-2-(p-tolylsulfanyl)-1H-indole CAS Name: 6-methoxy-2-[(4-methylphenyl)thio]-3-nitro-1H-indole IUPAC Name: 6-methoxy-2-(4-methylphenyl)sulfanyl-3-nitro-1H-indole Traditional Name: 6-methoxy-3-nitro-2-(p-tolylthio)-1H-indole Formula: C16H14N2O3S MolecularWeight: 314.35896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C3=C(N2)C=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C3=C(N2)C=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C16H14N2O3S/c1-10-3-6-12(7-4-10)22-16-15(18(19)20)13-8-5-11(21-2)9-14(13)17-16/h3-9,17H,1-2H3