2-(3-chlorophenyl)-4-(4-chlorophenyl)sulfanyl-6-(4-methylpiperazin-1-yl)pyrimidine

Systemtic Name: 2-(3-chlorophenyl)-4-(4-chlorophenyl)sulfanyl-6-(4-methylpiperazin-1-yl)pyrimidine Openeye Name: 2-(3-chlorophenyl)-4-(4-chlorophenyl)sulfanyl-6-(4-methylpiperazin-1-yl)pyrimidine CAS Name: 2-(3-chlorophenyl)-4-[(4-chlorophenyl)thio]-6-(4-methyl-1-piperazinyl)pyrimidine IUPAC Name: 2-(3-chlorophenyl)-4-(4-chlorophenyl)sulfanyl-6-(4-methylpiperazin-1-yl)pyrimidine Traditional Name: 2-(3-chlorophenyl)-4-[(4-chlorophenyl)thio]-6-(4-methylpiperazino)pyrimidine Formula: C21H20Cl2N4S MolecularWeight: 431.3813

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20Cl2N4S/c1-26-9-11-27(12-10-26)19-14-20(28-18-7-5-16(22)6-8-18)25-21(24-19)15-3-2-4-17(23)13-15/h2-8,13-14H,9-12H2,1H3