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

Systemtic Name: 4-[4-(diphenylmethyl)piperazin-1-yl]-2-methyl-6-(5-thiophen-2-ylpyridin-3-yl)pyrimidine Openeye Name: 4-(4-benzhydrylpiperazin-1-yl)-2-methyl-6-[5-(2-thienyl)-3-pyridyl]pyrimidine CAS Name: 4-[4-(diphenylmethyl)-1-piperazinyl]-2-methyl-6-(5-thiophen-2-yl-3-pyridinyl)pyrimidine IUPAC Name: 4-(4-benzhydrylpiperazin-1-yl)-2-methyl-6-(5-thiophen-2-ylpyridin-3-yl)pyrimidine Traditional Name: 4-(4-benzhydrylpiperazino)-2-methyl-6-[5-(2-thienyl)-3-pyridyl]pyrimidine Formula: C31H29N5S MolecularWeight: 503.66046

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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=CC=CS6

Isomeric SMILES

CC1=NC(=CC(=N1)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC(=CN=C5)C6=CC=CS6

InChI

InChI=1S/C31H29N5S/c1-23-33-28(26-19-27(22-32-21-26)29-13-8-18-37-29)20-30(34-23)35-14-16-36(17-15-35)31(24-9-4-2-5-10-24)25-11-6-3-7-12-25/h2-13,18-22,31H,14-17H2,1H3