(4,7-dimethoxy-1-benzothiophen-2-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: (4,7-dimethoxy-1-benzothiophen-2-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: (4,7-dimethoxybenzothiophen-2-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: (4,7-dimethoxy-1-benzothiophen-2-yl)-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: (4,7-dimethoxy-1-benzothiophen-2-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: (4,7-dimethoxybenzothiophen-2-yl)-[4-(2-pyrimidyl)piperazino]methanone Formula: C19H20N4O3S MolecularWeight: 384.4521

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C=C(SC2=C(C=C1)OC)C(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

COC1=C2C=C(SC2=C(C=C1)OC)C(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C19H20N4O3S/c1-25-14-4-5-15(26-2)17-13(14)12-16(27-17)18(24)22-8-10-23(11-9-22)19-20-6-3-7-21-19/h3-7,12H,8-11H2,1-2H3