3-methyl-N-(4-methyl-2-nitro-phenyl)-2-[2-[(4-methylpyridin-2-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-butanamide

Systemtic Name: 3-methyl-N-(4-methyl-2-nitro-phenyl)-2-[2-[(4-methylpyridin-2-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-butanamide Openeye Name: 3-methyl-N-(4-methyl-2-nitro-phenyl)-2-[2-[(4-methyl-2-pyridyl)amino]-2-oxo-ethyl]sulfanyl-butanamide CAS Name: 3-methyl-N-(4-methyl-2-nitrophenyl)-2-[[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]thio]butanamide IUPAC Name: 3-methyl-N-(4-methyl-2-nitrophenyl)-2-[2-[(4-methylpyridin-2-yl)amino]-2-oxoethyl]sulfanylbutanamide Traditional Name: 2-[[2-keto-2-[(4-methyl-2-pyridyl)amino]ethyl]thio]-3-methyl-N-(4-methyl-2-nitro-phenyl)butyramide Formula: C20H24N4O4S MolecularWeight: 416.49396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(C(C)C)SCC(=O)NC2=NC=CC(=C2)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C(C(C)C)SCC(=O)NC2=NC=CC(=C2)C)[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O4S/c1-12(2)19(29-11-18(25)23-17-10-14(4)7-8-21-17)20(26)22-15-6-5-13(3)9-16(15)24(27)28/h5-10,12,19H,11H2,1-4H3,(H,22,26)(H,21,23,25)