N-(1,2-diethylpyrazolidin-4-yl)-4-(4-methylsulfanylphenyl)-4-oxidanylidene-butanamide

Systemtic Name: N-(1,2-diethylpyrazolidin-4-yl)-4-(4-methylsulfanylphenyl)-4-oxidanylidene-butanamide Openeye Name: N-(1,2-diethylpyrazolidin-4-yl)-4-(4-methylsulfanylphenyl)-4-oxo-butanamide CAS Name: N-(1,2-diethyl-4-pyrazolidinyl)-4-[4-(methylthio)phenyl]-4-oxobutanamide IUPAC Name: N-(1,2-diethylpyrazolidin-4-yl)-4-(4-methylsulfanylphenyl)-4-oxobutanamide Traditional Name: N-(1,2-diethylpyrazolidin-4-yl)-4-keto-4-[4-(methylthio)phenyl]butyramide Formula: C18H27N3O2S MolecularWeight: 349.49088

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC(CN1CC)NC(=O)CCC(=O)C2=CC=C(C=C2)SC

Isomeric SMILES

CCN1CC(CN1CC)NC(=O)CCC(=O)C2=CC=C(C=C2)SC

InChI

InChI=1S/C18H27N3O2S/c1-4-20-12-15(13-21(20)5-2)19-18(23)11-10-17(22)14-6-8-16(24-3)9-7-14/h6-9,15H,4-5,10-13H2,1-3H3,(H,19,23)