N-[[4-[2-(dimethylamino)-2-oxidanylidene-ethyl]phenyl]carbamothioyl]pentanamide

Systemtic Name: N-[[4-[2-(dimethylamino)-2-oxidanylidene-ethyl]phenyl]carbamothioyl]pentanamide Openeye Name: N-[[4-[2-(dimethylamino)-2-oxo-ethyl]phenyl]carbamothioyl]pentanamide CAS Name: N-[[4-[2-(dimethylamino)-2-oxoethyl]anilino]-sulfanylidenemethyl]pentanamide IUPAC Name: N-[[4-[2-(dimethylamino)-2-oxoethyl]phenyl]carbamothioyl]pentanamide Traditional Name: N-[[4-[2-(dimethylamino)-2-keto-ethyl]phenyl]thiocarbamoyl]valeramide Formula: C16H23N3O2S MolecularWeight: 321.43772

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23N3O2S/c1-4-5-6-14(20)18-16(22)17-13-9-7-12(8-10-13)11-15(21)19(2)3/h7-10H,4-6,11H2,1-3H3,(H2,17,18,20,22)