4-[5-(1-benzothiophen-2-yl)pyridin-3-yl]-6-[4-(diphenylmethyl)piperazin-1-yl]-2-methyl-pyrimidine

Systemtic Name: 4-[5-(1-benzothiophen-2-yl)pyridin-3-yl]-6-[4-(diphenylmethyl)piperazin-1-yl]-2-methyl-pyrimidine Openeye Name: 4-(4-benzhydrylpiperazin-1-yl)-6-[5-(benzothiophen-2-yl)-3-pyridyl]-2-methyl-pyrimidine CAS Name: 4-[5-(1-benzothiophen-2-yl)-3-pyridinyl]-6-[4-(diphenylmethyl)-1-piperazinyl]-2-methylpyrimidine IUPAC Name: 4-(4-benzhydrylpiperazin-1-yl)-6-[5-(1-benzothiophen-2-yl)pyridin-3-yl]-2-methylpyrimidine Traditional Name: 4-(4-benzhydrylpiperazino)-6-[5-(benzothiophen-2-yl)-3-pyridyl]-2-methyl-pyrimidine Formula: C35H31N5S MolecularWeight: 553.71914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC(=CN=C5)C6=CC7=CC=CC=C7S6

Isomeric SMILES

CC1=NC(=CC(=N1)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC(=CN=C5)C6=CC7=CC=CC=C7S6

InChI

InChI=1S/C35H31N5S/c1-25-37-31(29-20-30(24-36-23-29)33-21-28-14-8-9-15-32(28)41-33)22-34(38-25)39-16-18-40(19-17-39)35(26-10-4-2-5-11-26)27-12-6-3-7-13-27/h2-15,20-24,35H,16-19H2,1H3