2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]-N-(2-methylpropylcarbamoyl)propanamide

Systemtic Name: 2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]-N-(2-methylpropylcarbamoyl)propanamide Openeye Name: N-(isobutylcarbamoyl)-2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]propanamide CAS Name: 2-[methyl-[[4-(methylthio)phenyl]methyl]amino]-N-[(2-methylpropylamino)-oxomethyl]propanamide IUPAC Name: 2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]-N-(2-methylpropylcarbamoyl)propanamide Traditional Name: N-(isobutylcarbamoyl)-2-[methyl-[4-(methylthio)benzyl]amino]propionamide Formula: C17H27N3O2S MolecularWeight: 337.48018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)NC(=O)C(C)N(C)CC1=CC=C(C=C1)SC

Isomeric SMILES

CC(C)CNC(=O)NC(=O)C(C)N(C)CC1=CC=C(C=C1)SC

InChI

InChI=1S/C17H27N3O2S/c1-12(2)10-18-17(22)19-16(21)13(3)20(4)11-14-6-8-15(23-5)9-7-14/h6-9,12-13H,10-11H2,1-5H3,(H2,18,19,21,22)