4-[2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylethanoylamino]-N-phenyl-piperidine-1-carboxamide

Systemtic Name: 4-[2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylethanoylamino]-N-phenyl-piperidine-1-carboxamide Openeye Name: 4-[[2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetyl]amino]-N-phenyl-piperidine-1-carboxamide CAS Name: 4-[[2-[(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)thio]-1-oxoethyl]amino]-N-phenyl-1-piperidinecarboxamide IUPAC Name: 4-[[2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetyl]amino]-N-phenylpiperidine-1-carboxamide Traditional Name: 4-[[2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)thio]acetyl]amino]-N-phenyl-piperidine-1-carboxamide Formula: C22H25N5O2S2 MolecularWeight: 455.5962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=NC=N2)SCC(=O)NC3CCN(CC3)C(=O)NC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(SC2=C1C(=NC=N2)SCC(=O)NC3CCN(CC3)C(=O)NC4=CC=CC=C4)C

InChI

InChI=1S/C22H25N5O2S2/c1-14-15(2)31-21-19(14)20(23-13-24-21)30-12-18(28)25-17-8-10-27(11-9-17)22(29)26-16-6-4-3-5-7-16/h3-7,13,17H,8-12H2,1-2H3,(H,25,28)(H,26,29)