3-[2-(2-methylphenyl)ethanoylcarbamothioylamino]-N,N-dipropyl-benzamide

Systemtic Name: 3-[2-(2-methylphenyl)ethanoylcarbamothioylamino]-N,N-dipropyl-benzamide Openeye Name: 3-[[2-(o-tolyl)acetyl]carbamothioylamino]-N,N-dipropyl-benzamide CAS Name: 3-[[[[2-(2-methylphenyl)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]-N,N-dipropylbenzamide IUPAC Name: 3-[[2-(2-methylphenyl)acetyl]carbamothioylamino]-N,N-dipropylbenzamide Traditional Name: 3-[[2-(o-tolyl)acetyl]thiocarbamoylamino]-N,N-dipropyl-benzamide Formula: C23H29N3O2S MolecularWeight: 411.56026

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)C1=CC(=CC=C1)NC(=S)NC(=O)CC2=CC=CC=C2C

Isomeric SMILES

CCCN(CCC)C(=O)C1=CC(=CC=C1)NC(=S)NC(=O)CC2=CC=CC=C2C

InChI

InChI=1S/C23H29N3O2S/c1-4-13-26(14-5-2)22(28)19-11-8-12-20(15-19)24-23(29)25-21(27)16-18-10-7-6-9-17(18)3/h6-12,15H,4-5,13-14,16H2,1-3H3,(H2,24,25,27,29)