2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]-N-(2-methyl-5-nitro-phenyl)ethanamide

Systemtic Name: 2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]-N-(2-methyl-5-nitro-phenyl)ethanamide Openeye Name: 2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]-N-(2-methyl-5-nitro-phenyl)acetamide CAS Name: 2-[methyl-[[4-(methylthio)phenyl]methyl]amino]-N-(2-methyl-5-nitrophenyl)acetamide IUPAC Name: 2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]-N-(2-methyl-5-nitrophenyl)acetamide Traditional Name: 2-[methyl-[4-(methylthio)benzyl]amino]-N-(2-methyl-5-nitro-phenyl)acetamide Formula: C18H21N3O3S MolecularWeight: 359.44264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CN(C)CC2=CC=C(C=C2)SC

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CN(C)CC2=CC=C(C=C2)SC

InChI

InChI=1S/C18H21N3O3S/c1-13-4-7-15(21(23)24)10-17(13)19-18(22)12-20(2)11-14-5-8-16(25-3)9-6-14/h4-10H,11-12H2,1-3H3,(H,19,22)