N-[[4-[3-(dimethylamino)-3-oxidanylidene-propyl]phenyl]carbamothioyl]hexanamide

Systemtic Name: N-[[4-[3-(dimethylamino)-3-oxidanylidene-propyl]phenyl]carbamothioyl]hexanamide Openeye Name: N-[[4-[3-(dimethylamino)-3-oxo-propyl]phenyl]carbamothioyl]hexanamide CAS Name: N-[[4-[3-(dimethylamino)-3-oxopropyl]anilino]-sulfanylidenemethyl]hexanamide IUPAC Name: N-[[4-[3-(dimethylamino)-3-oxopropyl]phenyl]carbamothioyl]hexanamide Traditional Name: N-[[4-[3-(dimethylamino)-3-keto-propyl]phenyl]thiocarbamoyl]hexanamide Formula: C18H27N3O2S MolecularWeight: 349.49088

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27N3O2S/c1-4-5-6-7-16(22)20-18(24)19-15-11-8-14(9-12-15)10-13-17(23)21(2)3/h8-9,11-12H,4-7,10,13H2,1-3H3,(H2,19,20,22,24)