2-[(2-chlorophenyl)methylsulfanyl]-4-(4-methylpiperazin-1-yl)pyrimidine

Systemtic Name: 2-[(2-chlorophenyl)methylsulfanyl]-4-(4-methylpiperazin-1-yl)pyrimidine Openeye Name: 2-[(2-chlorophenyl)methylsulfanyl]-4-(4-methylpiperazin-1-yl)pyrimidine CAS Name: 2-[(2-chlorophenyl)methylthio]-4-(4-methyl-1-piperazinyl)pyrimidine IUPAC Name: 2-[(2-chlorophenyl)methylsulfanyl]-4-(4-methylpiperazin-1-yl)pyrimidine Traditional Name: 2-[(2-chlorobenzyl)thio]-4-(4-methylpiperazino)pyrimidine Formula: C16H19ClN4S MolecularWeight: 334.86686

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC(=NC=C2)SCC3=CC=CC=C3Cl

Isomeric SMILES

CN1CCN(CC1)C2=NC(=NC=C2)SCC3=CC=CC=C3Cl

InChI

InChI=1S/C16H19ClN4S/c1-20-8-10-21(11-9-20)15-6-7-18-16(19-15)22-12-13-4-2-3-5-14(13)17/h2-7H,8-12H2,1H3