N-[[3-(2,2-dimethylpropanoylamino)phenyl]carbamothioyl]pentanamide

Systemtic Name: N-[[3-(2,2-dimethylpropanoylamino)phenyl]carbamothioyl]pentanamide Openeye Name: N-[[3-(2,2-dimethylpropanoylamino)phenyl]carbamothioyl]pentanamide CAS Name: N-[[3-[(2,2-dimethyl-1-oxopropyl)amino]anilino]-sulfanylidenemethyl]pentanamide IUPAC Name: N-[[3-(2,2-dimethylpropanoylamino)phenyl]carbamothioyl]pentanamide Traditional Name: N-[[3-(pivaloylamino)phenyl]thiocarbamoyl]valeramide Formula: C17H25N3O2S MolecularWeight: 335.4643

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25N3O2S/c1-5-6-10-14(21)20-16(23)19-13-9-7-8-12(11-13)18-15(22)17(2,3)4/h7-9,11H,5-6,10H2,1-4H3,(H,18,22)(H2,19,20,21,23)