4-(4-chlorophenyl)sulfanyl-2-(4-methoxyphenyl)-6-(4-methylpiperazin-1-yl)pyrimidine

Systemtic Name: 4-(4-chlorophenyl)sulfanyl-2-(4-methoxyphenyl)-6-(4-methylpiperazin-1-yl)pyrimidine Openeye Name: 4-(4-chlorophenyl)sulfanyl-2-(4-methoxyphenyl)-6-(4-methylpiperazin-1-yl)pyrimidine CAS Name: 4-[(4-chlorophenyl)thio]-2-(4-methoxyphenyl)-6-(4-methyl-1-piperazinyl)pyrimidine IUPAC Name: 4-(4-chlorophenyl)sulfanyl-2-(4-methoxyphenyl)-6-(4-methylpiperazin-1-yl)pyrimidine Traditional Name: 4-[(4-chlorophenyl)thio]-2-(4-methoxyphenyl)-6-(4-methylpiperazino)pyrimidine Formula: C22H23ClN4OS MolecularWeight: 426.96222

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23ClN4OS/c1-26-11-13-27(14-12-26)20-15-21(29-19-9-5-17(23)6-10-19)25-22(24-20)16-3-7-18(28-2)8-4-16/h3-10,15H,11-14H2,1-2H3