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

Systemtic Name: N-[3-[1-[(2-methyl-4-nitro-phenyl)amino]-1-oxidanylidene-butan-2-yl]sulfanylphenyl]naphthalene-2-carboxamide Openeye Name: N-[3-[1-[(2-methyl-4-nitro-phenyl)carbamoyl]propylsulfanyl]phenyl]naphthalene-2-carboxamide CAS Name: N-[3-[[1-(2-methyl-4-nitroanilino)-1-oxobutan-2-yl]thio]phenyl]-2-naphthalenecarboxamide IUPAC Name: N-[3-[1-(2-methyl-4-nitroanilino)-1-oxobutan-2-yl]sulfanylphenyl]naphthalene-2-carboxamide Traditional Name: N-[3-[1-[(2-methyl-4-nitro-phenyl)carbamoyl]propylthio]phenyl]-2-naphthamide Formula: C28H25N3O4S MolecularWeight: 499.5808

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])C)SC2=CC=CC(=C2)NC(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CCC(C(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])C)SC2=CC=CC(=C2)NC(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C28H25N3O4S/c1-3-26(28(33)30-25-14-13-23(31(34)35)15-18(25)2)36-24-10-6-9-22(17-24)29-27(32)21-12-11-19-7-4-5-8-20(19)16-21/h4-17,26H,3H2,1-2H3,(H,29,32)(H,30,33)