N-[3-(2-methylpropanoylcarbamothioylamino)phenyl]butanamide

Systemtic Name: N-[3-(2-methylpropanoylcarbamothioylamino)phenyl]butanamide Openeye Name: N-[3-(2-methylpropanoylcarbamothioylamino)phenyl]butanamide CAS Name: N-[3-[[[(2-methyl-1-oxopropyl)amino]-sulfanylidenemethyl]amino]phenyl]butanamide IUPAC Name: N-[3-(2-methylpropanoylcarbamothioylamino)phenyl]butanamide Traditional Name: N-[3-(isobutyrylthiocarbamoylamino)phenyl]butyramide Formula: C15H21N3O2S MolecularWeight: 307.41114

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21N3O2S/c1-4-6-13(19)16-11-7-5-8-12(9-11)17-15(21)18-14(20)10(2)3/h5,7-10H,4,6H2,1-3H3,(H,16,19)(H2,17,18,20,21)