3-methyl-N-[[2-methyl-3-(propanoylamino)phenyl]carbamothioyl]butanamide

Systemtic Name: 3-methyl-N-[[2-methyl-3-(propanoylamino)phenyl]carbamothioyl]butanamide Openeye Name: 3-methyl-N-[[2-methyl-3-(propanoylamino)phenyl]carbamothioyl]butanamide CAS Name: 3-methyl-N-[[2-methyl-3-(1-oxopropylamino)anilino]-sulfanylidenemethyl]butanamide IUPAC Name: 3-methyl-N-[[2-methyl-3-(propanoylamino)phenyl]carbamothioyl]butanamide Traditional Name: 3-methyl-N-[(2-methyl-3-propionamido-phenyl)thiocarbamoyl]butyramide Formula: C16H23N3O2S MolecularWeight: 321.43772

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23N3O2S/c1-5-14(20)17-12-7-6-8-13(11(12)4)18-16(22)19-15(21)9-10(2)3/h6-8,10H,5,9H2,1-4H3,(H,17,20)(H2,18,19,21,22)