N-[[3-[3-(dimethylamino)-3-oxidanylidene-propyl]phenyl]carbamothioyl]pentanamide

Systemtic Name: N-[[3-[3-(dimethylamino)-3-oxidanylidene-propyl]phenyl]carbamothioyl]pentanamide Openeye Name: N-[[3-[3-(dimethylamino)-3-oxo-propyl]phenyl]carbamothioyl]pentanamide CAS Name: N-[[3-[3-(dimethylamino)-3-oxopropyl]anilino]-sulfanylidenemethyl]pentanamide IUPAC Name: N-[[3-[3-(dimethylamino)-3-oxopropyl]phenyl]carbamothioyl]pentanamide Traditional Name: N-[[3-[3-(dimethylamino)-3-keto-propyl]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)CCC(=O)N(C)C

Isomeric SMILES

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

InChI

InChI=1S/C17H25N3O2S/c1-4-5-9-15(21)19-17(23)18-14-8-6-7-13(12-14)10-11-16(22)20(2)3/h6-8,12H,4-5,9-11H2,1-3H3,(H2,18,19,21,23)