4-methoxy-2-[4-[(5-thiophen-3-yl-1-benzofuran-2-yl)methyl]piperazin-1-yl]pyrimidine

Systemtic Name: 4-methoxy-2-[4-[(5-thiophen-3-yl-1-benzofuran-2-yl)methyl]piperazin-1-yl]pyrimidine Openeye Name: 4-methoxy-2-[4-[[5-(3-thienyl)benzofuran-2-yl]methyl]piperazin-1-yl]pyrimidine CAS Name: 4-methoxy-2-[4-[[5-(3-thiophenyl)-2-benzofuranyl]methyl]-1-piperazinyl]pyrimidine IUPAC Name: 4-methoxy-2-[4-[(5-thiophen-3-yl-1-benzofuran-2-yl)methyl]piperazin-1-yl]pyrimidine Traditional Name: 4-methoxy-2-[4-[[5-(3-thienyl)benzofuran-2-yl]methyl]piperazino]pyrimidine Formula: C22H22N4O2S MolecularWeight: 406.50068

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC=C1)N2CCN(CC2)CC3=CC4=C(O3)C=CC(=C4)C5=CSC=C5

Isomeric SMILES

COC1=NC(=NC=C1)N2CCN(CC2)CC3=CC4=C(O3)C=CC(=C4)C5=CSC=C5

InChI

InChI=1S/C22H22N4O2S/c1-27-21-4-6-23-22(24-21)26-9-7-25(8-10-26)14-19-13-18-12-16(2-3-20(18)28-19)17-5-11-29-15-17/h2-6,11-13,15H,7-10,14H2,1H3