1-[2-[4-oxidanylidene-3-(phenylmethyl)thieno[3,2-d]pyrimidin-2-yl]sulfanylethanoyl]piperidine-4-carboxamide

Systemtic Name: 1-[2-[4-oxidanylidene-3-(phenylmethyl)thieno[3,2-d]pyrimidin-2-yl]sulfanylethanoyl]piperidine-4-carboxamide Openeye Name: 1-[2-(3-benzyl-4-oxo-thieno[3,2-d]pyrimidin-2-yl)sulfanylacetyl]piperidine-4-carboxamide CAS Name: 1-[1-oxo-2-[[4-oxo-3-(phenylmethyl)-2-thieno[3,2-d]pyrimidinyl]thio]ethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-(3-benzyl-4-oxothieno[3,2-d]pyrimidin-2-yl)sulfanylacetyl]piperidine-4-carboxamide Traditional Name: 1-[2-[(3-benzyl-4-keto-thieno[3,2-d]pyrimidin-2-yl)thio]acetyl]isonipecotamide Formula: C21H22N4O3S2 MolecularWeight: 442.55438

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)C(=O)CSC2=NC3=C(C(=O)N2CC4=CC=CC=C4)SC=C3

Isomeric SMILES

C1CN(CCC1C(=O)N)C(=O)CSC2=NC3=C(C(=O)N2CC4=CC=CC=C4)SC=C3

InChI

InChI=1S/C21H22N4O3S2/c22-19(27)15-6-9-24(10-7-15)17(26)13-30-21-23-16-8-11-29-18(16)20(28)25(21)12-14-4-2-1-3-5-14/h1-5,8,11,15H,6-7,9-10,12-13H2,(H2,22,27)