3-(3-methylbutanoylcarbamothioylamino)-N,N-dipropyl-benzamide

Systemtic Name: 3-(3-methylbutanoylcarbamothioylamino)-N,N-dipropyl-benzamide Openeye Name: 3-(3-methylbutanoylcarbamothioylamino)-N,N-dipropyl-benzamide CAS Name: 3-[[[(3-methyl-1-oxobutyl)amino]-sulfanylidenemethyl]amino]-N,N-dipropylbenzamide IUPAC Name: 3-(3-methylbutanoylcarbamothioylamino)-N,N-dipropylbenzamide Traditional Name: 3-(isovalerylthiocarbamoylamino)-N,N-dipropyl-benzamide Formula: C19H29N3O2S MolecularWeight: 363.51746

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H29N3O2S/c1-5-10-22(11-6-2)18(24)15-8-7-9-16(13-15)20-19(25)21-17(23)12-14(3)4/h7-9,13-14H,5-6,10-12H2,1-4H3,(H2,20,21,23,25)