N-[3-[1-[(2-methyl-4-nitro-phenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylphenyl]naphthalene-2-carboxamide

Systemtic Name: N-[3-[1-[(2-methyl-4-nitro-phenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylphenyl]naphthalene-2-carboxamide Openeye Name: N-[3-[1-methyl-2-(2-methyl-4-nitro-anilino)-2-oxo-ethyl]sulfanylphenyl]naphthalene-2-carboxamide CAS Name: N-[3-[[1-(2-methyl-4-nitroanilino)-1-oxopropan-2-yl]thio]phenyl]-2-naphthalenecarboxamide IUPAC Name: N-[3-[1-(2-methyl-4-nitroanilino)-1-oxopropan-2-yl]sulfanylphenyl]naphthalene-2-carboxamide Traditional Name: N-[3-[[2-keto-1-methyl-2-(2-methyl-4-nitro-anilino)ethyl]thio]phenyl]-2-naphthamide Formula: C27H23N3O4S MolecularWeight: 485.55422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C(C)SC2=CC=CC(=C2)NC(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C(C)SC2=CC=CC(=C2)NC(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C27H23N3O4S/c1-17-14-23(30(33)34)12-13-25(17)29-26(31)18(2)35-24-9-5-8-22(16-24)28-27(32)21-11-10-19-6-3-4-7-20(19)15-21/h3-16,18H,1-2H3,(H,28,32)(H,29,31)