4-[2-(3-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)sulfanylethanoyl]-N-phenyl-piperazine-1-carboxamide

Systemtic Name: 4-[2-(3-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)sulfanylethanoyl]-N-phenyl-piperazine-1-carboxamide Openeye Name: 4-[2-(3-methyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanylacetyl]-N-phenyl-piperazine-1-carboxamide CAS Name: 4-[2-[(3-methyl-4-oxo-2-thieno[2,3-d]pyrimidinyl)thio]-1-oxoethyl]-N-phenyl-1-piperazinecarboxamide IUPAC Name: 4-[2-(3-methyl-4-oxothieno[2,3-d]pyrimidin-2-yl)sulfanylacetyl]-N-phenylpiperazine-1-carboxamide Traditional Name: 4-[2-[(4-keto-3-methyl-thieno[2,3-d]pyrimidin-2-yl)thio]acetyl]-N-phenyl-piperazine-1-carboxamide Formula: C20H21N5O3S2 MolecularWeight: 443.54244

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=C1SCC(=O)N3CCN(CC3)C(=O)NC4=CC=CC=C4)SC=C2

Isomeric SMILES

CN1C(=O)C2=C(N=C1SCC(=O)N3CCN(CC3)C(=O)NC4=CC=CC=C4)SC=C2

InChI

InChI=1S/C20H21N5O3S2/c1-23-18(27)15-7-12-29-17(15)22-20(23)30-13-16(26)24-8-10-25(11-9-24)19(28)21-14-5-3-2-4-6-14/h2-7,12H,8-11,13H2,1H3,(H,21,28)