4-(2-methylpropanoylcarbamothioylamino)-N-(1-phenylethyl)benzamide

Systemtic Name: 4-(2-methylpropanoylcarbamothioylamino)-N-(1-phenylethyl)benzamide Openeye Name: 4-(2-methylpropanoylcarbamothioylamino)-N-(1-phenylethyl)benzamide CAS Name: 4-[[[(2-methyl-1-oxopropyl)amino]-sulfanylidenemethyl]amino]-N-(1-phenylethyl)benzamide IUPAC Name: 4-(2-methylpropanoylcarbamothioylamino)-N-(1-phenylethyl)benzamide Traditional Name: 4-(isobutyrylthiocarbamoylamino)-N-(1-phenylethyl)benzamide Formula: C20H23N3O2S MolecularWeight: 369.48052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC(=S)NC1=CC=C(C=C1)C(=O)NC(C)C2=CC=CC=C2

Isomeric SMILES

CC(C)C(=O)NC(=S)NC1=CC=C(C=C1)C(=O)NC(C)C2=CC=CC=C2

InChI

InChI=1S/C20H23N3O2S/c1-13(2)18(24)23-20(26)22-17-11-9-16(10-12-17)19(25)21-14(3)15-7-5-4-6-8-15/h4-14H,1-3H3,(H,21,25)(H2,22,23,24,26)