4-(phenylmethylsulfanyl)-6-(4-phenylpiperazin-1-yl)pyrimidine

Systemtic Name: 4-(phenylmethylsulfanyl)-6-(4-phenylpiperazin-1-yl)pyrimidine Openeye Name: 4-benzylsulfanyl-6-(4-phenylpiperazin-1-yl)pyrimidine CAS Name: 4-(phenylmethylthio)-6-(4-phenyl-1-piperazinyl)pyrimidine IUPAC Name: 4-benzylsulfanyl-6-(4-phenylpiperazin-1-yl)pyrimidine Traditional Name: 4-(benzylthio)-6-(4-phenylpiperazino)pyrimidine Formula: C21H22N4S MolecularWeight: 362.49118

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N4S/c1-3-7-18(8-4-1)16-26-21-15-20(22-17-23-21)25-13-11-24(12-14-25)19-9-5-2-6-10-19/h1-10,15,17H,11-14,16H2