N-[6-ethyl-4-[4-(4-phenylphenyl)carbonylpiperazin-1-yl]thieno[2,3-d]pyrimidin-2-yl]ethanamide

Systemtic Name: N-[6-ethyl-4-[4-(4-phenylphenyl)carbonylpiperazin-1-yl]thieno[2,3-d]pyrimidin-2-yl]ethanamide Openeye Name: N-[6-ethyl-4-[4-(4-phenylbenzoyl)piperazin-1-yl]thieno[2,3-d]pyrimidin-2-yl]acetamide CAS Name: N-[6-ethyl-4-[4-[oxo-(4-phenylphenyl)methyl]-1-piperazinyl]-2-thieno[2,3-d]pyrimidinyl]acetamide IUPAC Name: N-[6-ethyl-4-[4-(4-phenylbenzoyl)piperazin-1-yl]thieno[2,3-d]pyrimidin-2-yl]acetamide Traditional Name: N-[6-ethyl-4-[4-(4-phenylbenzoyl)piperazino]thieno[2,3-d]pyrimidin-2-yl]acetamide Formula: C27H27N5O2S MolecularWeight: 485.60058

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(N=C(N=C2S1)NC(=O)C)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

CCC1=CC2=C(N=C(N=C2S1)NC(=O)C)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H27N5O2S/c1-3-22-17-23-24(29-27(28-18(2)33)30-25(23)35-22)31-13-15-32(16-14-31)26(34)21-11-9-20(10-12-21)19-7-5-4-6-8-19/h4-12,17H,3,13-16H2,1-2H3,(H,28,29,30,33)