2-(dimethylamino)-N-(2-methylpropyl)-5-[(4-methylsulfanylphenyl)carbamoylamino]benzamide

Systemtic Name: 2-(dimethylamino)-N-(2-methylpropyl)-5-[(4-methylsulfanylphenyl)carbamoylamino]benzamide Openeye Name: 2-(dimethylamino)-N-isobutyl-5-[(4-methylsulfanylphenyl)carbamoylamino]benzamide CAS Name: 2-(dimethylamino)-N-(2-methylpropyl)-5-[[[4-(methylthio)anilino]-oxomethyl]amino]benzamide IUPAC Name: 2-(dimethylamino)-N-(2-methylpropyl)-5-[(4-methylsulfanylphenyl)carbamoylamino]benzamide Traditional Name: 2-(dimethylamino)-N-isobutyl-5-[[4-(methylthio)phenyl]carbamoylamino]benzamide Formula: C21H28N4O2S MolecularWeight: 400.53762

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=C(C=CC(=C1)NC(=O)NC2=CC=C(C=C2)SC)N(C)C

Isomeric SMILES

CC(C)CNC(=O)C1=C(C=CC(=C1)NC(=O)NC2=CC=C(C=C2)SC)N(C)C

InChI

InChI=1S/C21H28N4O2S/c1-14(2)13-22-20(26)18-12-16(8-11-19(18)25(3)4)24-21(27)23-15-6-9-17(28-5)10-7-15/h6-12,14H,13H2,1-5H3,(H,22,26)(H2,23,24,27)