5-(1-benzothiophen-2-yl)-2-[4-(diphenylmethyl)piperazin-1-yl]pyrimidine

Systemtic Name: 5-(1-benzothiophen-2-yl)-2-[4-(diphenylmethyl)piperazin-1-yl]pyrimidine Openeye Name: 2-(4-benzhydrylpiperazin-1-yl)-5-(benzothiophen-2-yl)pyrimidine CAS Name: 5-(1-benzothiophen-2-yl)-2-[4-(diphenylmethyl)-1-piperazinyl]pyrimidine IUPAC Name: 2-(4-benzhydrylpiperazin-1-yl)-5-(1-benzothiophen-2-yl)pyrimidine Traditional Name: 2-(4-benzhydrylpiperazino)-5-(benzothiophen-2-yl)pyrimidine Formula: C29H26N4S MolecularWeight: 462.60854

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=N2)C3=CC4=CC=CC=C4S3)C(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=N2)C3=CC4=CC=CC=C4S3)C(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C29H26N4S/c1-3-9-22(10-4-1)28(23-11-5-2-6-12-23)32-15-17-33(18-16-32)29-30-20-25(21-31-29)27-19-24-13-7-8-14-26(24)34-27/h1-14,19-21,28H,15-18H2