1-[(6-ethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)methyl]-N-phenyl-piperidine-3-carboxamide

Systemtic Name: 1-[(6-ethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)methyl]-N-phenyl-piperidine-3-carboxamide Openeye Name: 1-[(6-ethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)methyl]-N-phenyl-piperidine-3-carboxamide CAS Name: 1-[(6-ethyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)methyl]-N-phenyl-3-piperidinecarboxamide IUPAC Name: 1-[(6-ethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)methyl]-N-phenylpiperidine-3-carboxamide Traditional Name: 1-[(6-ethyl-4-keto-thieno[2,3-d]pyrimidin-3-yl)methyl]-N-phenyl-nipecotamide Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)N=CN(C2=O)CN3CCCC(C3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CCC1=CC2=C(S1)N=CN(C2=O)CN3CCCC(C3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C21H24N4O2S/c1-2-17-11-18-20(28-17)22-13-25(21(18)27)14-24-10-6-7-15(12-24)19(26)23-16-8-4-3-5-9-16/h3-5,8-9,11,13,15H,2,6-7,10,12,14H2,1H3,(H,23,26)