3-methyl-N-[[3-(propanoylamino)phenyl]carbamothioyl]butanamide

Systemtic Name: 3-methyl-N-[[3-(propanoylamino)phenyl]carbamothioyl]butanamide Openeye Name: 3-methyl-N-[[3-(propanoylamino)phenyl]carbamothioyl]butanamide CAS Name: 3-methyl-N-[[3-(1-oxopropylamino)anilino]-sulfanylidenemethyl]butanamide IUPAC Name: 3-methyl-N-[[3-(propanoylamino)phenyl]carbamothioyl]butanamide Traditional Name: 3-methyl-N-[(3-propionamidophenyl)thiocarbamoyl]butyramide Formula: C15H21N3O2S MolecularWeight: 307.41114

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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