(5-phenyl-3-phenylmethoxy-thiophen-2-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: (5-phenyl-3-phenylmethoxy-thiophen-2-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: (3-benzyloxy-5-phenyl-2-thienyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: (5-phenyl-3-phenylmethoxy-2-thiophenyl)-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: (5-phenyl-3-phenylmethoxythiophen-2-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: (3-benzoxy-5-phenyl-2-thienyl)-[4-(2-pyrimidyl)piperazino]methanone Formula: C26H24N4O2S MolecularWeight: 456.55936

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=C(C=C(S3)C4=CC=CC=C4)OCC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=C(C=C(S3)C4=CC=CC=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C26H24N4O2S/c31-25(29-14-16-30(17-15-29)26-27-12-7-13-28-26)24-22(32-19-20-8-3-1-4-9-20)18-23(33-24)21-10-5-2-6-11-21/h1-13,18H,14-17,19H2