4-(4-phenylpiperazin-1-yl)-6-(pyridin-3-ylmethylsulfanyl)pyrimidine

Systemtic Name: 4-(4-phenylpiperazin-1-yl)-6-(pyridin-3-ylmethylsulfanyl)pyrimidine Openeye Name: 4-(4-phenylpiperazin-1-yl)-6-(3-pyridylmethylsulfanyl)pyrimidine CAS Name: 4-(4-phenyl-1-piperazinyl)-6-(3-pyridinylmethylthio)pyrimidine IUPAC Name: 4-(4-phenylpiperazin-1-yl)-6-(pyridin-3-ylmethylsulfanyl)pyrimidine Traditional Name: 4-(4-phenylpiperazino)-6-(3-pyridylmethylthio)pyrimidine Formula: C20H21N5S MolecularWeight: 363.47924

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C3=CC(=NC=N3)SCC4=CN=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C3=CC(=NC=N3)SCC4=CN=CC=C4

InChI

InChI=1S/C20H21N5S/c1-2-6-18(7-3-1)24-9-11-25(12-10-24)19-13-20(23-16-22-19)26-15-17-5-4-8-21-14-17/h1-8,13-14,16H,9-12,15H2