4-(4-methylpiperazin-1-yl)-2-phenyl-6-phenylsulfanyl-pyrimidine

Systemtic Name: 4-(4-methylpiperazin-1-yl)-2-phenyl-6-phenylsulfanyl-pyrimidine Openeye Name: 4-(4-methylpiperazin-1-yl)-2-phenyl-6-phenylsulfanyl-pyrimidine CAS Name: 4-(4-methyl-1-piperazinyl)-2-phenyl-6-(phenylthio)pyrimidine IUPAC Name: 4-(4-methylpiperazin-1-yl)-2-phenyl-6-phenylsulfanylpyrimidine Traditional Name: 4-(4-methylpiperazino)-2-phenyl-6-(phenylthio)pyrimidine Formula: C21H22N4S MolecularWeight: 362.49118

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC(=NC(=N2)C3=CC=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

CN1CCN(CC1)C2=CC(=NC(=N2)C3=CC=CC=C3)SC4=CC=CC=C4

InChI

InChI=1S/C21H22N4S/c1-24-12-14-25(15-13-24)19-16-20(26-18-10-6-3-7-11-18)23-21(22-19)17-8-4-2-5-9-17/h2-11,16H,12-15H2,1H3