4-(4-methylpiperazin-1-yl)-6-(phenylmethylsulfanyl)pyrimidin-2-amine

Systemtic Name: 4-(4-methylpiperazin-1-yl)-6-(phenylmethylsulfanyl)pyrimidin-2-amine Openeye Name: 4-benzylsulfanyl-6-(4-methylpiperazin-1-yl)pyrimidin-2-amine CAS Name: 4-(4-methyl-1-piperazinyl)-6-(phenylmethylthio)-2-pyrimidinamine IUPAC Name: 4-benzylsulfanyl-6-(4-methylpiperazin-1-yl)pyrimidin-2-amine Traditional Name: [4-(benzylthio)-6-(4-methylpiperazino)pyrimidin-2-yl]amine Formula: C16H21N5S MolecularWeight: 315.43644

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC(=NC(=N2)N)SCC3=CC=CC=C3

Isomeric SMILES

CN1CCN(CC1)C2=CC(=NC(=N2)N)SCC3=CC=CC=C3

InChI

InChI=1S/C16H21N5S/c1-20-7-9-21(10-8-20)14-11-15(19-16(17)18-14)22-12-13-5-3-2-4-6-13/h2-6,11H,7-10,12H2,1H3,(H2,17,18,19)