1-[2-[[6-[(4-chlorophenyl)sulfanylmethyl]-4-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]ethanoyl]piperidine-4-carboxamide

Systemtic Name: 1-[2-[[6-[(4-chlorophenyl)sulfanylmethyl]-4-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]ethanoyl]piperidine-4-carboxamide Openeye Name: 1-[2-[[6-[(4-chlorophenyl)sulfanylmethyl]-4-oxo-1H-pyrimidin-2-yl]sulfanyl]acetyl]piperidine-4-carboxamide CAS Name: 1-[2-[[6-[[(4-chlorophenyl)thio]methyl]-4-oxo-1H-pyrimidin-2-yl]thio]-1-oxoethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-[[6-[(4-chlorophenyl)sulfanylmethyl]-4-oxo-1H-pyrimidin-2-yl]sulfanyl]acetyl]piperidine-4-carboxamide Traditional Name: 1-[2-[[6-[[(4-chlorophenyl)thio]methyl]-4-keto-1H-pyrimidin-2-yl]thio]acetyl]isonipecotamide Formula: C19H21ClN4O3S2 MolecularWeight: 452.97804

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)C(=O)CSC2=NC(=O)C=C(N2)CSC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CCC1C(=O)N)C(=O)CSC2=NC(=O)C=C(N2)CSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H21ClN4O3S2/c20-13-1-3-15(4-2-13)28-10-14-9-16(25)23-19(22-14)29-11-17(26)24-7-5-12(6-8-24)18(21)27/h1-4,9,12H,5-8,10-11H2,(H2,21,27)(H,22,23,25)