4-(4-ethoxyphenyl)sulfanyl-2-(4-methylphenyl)-6-(4-methylpiperazin-1-yl)pyrimidine

Systemtic Name: 4-(4-ethoxyphenyl)sulfanyl-2-(4-methylphenyl)-6-(4-methylpiperazin-1-yl)pyrimidine Openeye Name: 4-(4-ethoxyphenyl)sulfanyl-6-(4-methylpiperazin-1-yl)-2-(p-tolyl)pyrimidine CAS Name: 4-[(4-ethoxyphenyl)thio]-2-(4-methylphenyl)-6-(4-methyl-1-piperazinyl)pyrimidine IUPAC Name: 4-(4-ethoxyphenyl)sulfanyl-2-(4-methylphenyl)-6-(4-methylpiperazin-1-yl)pyrimidine Traditional Name: 4-(4-methylpiperazino)-6-(p-phenetylthio)-2-(p-tolyl)pyrimidine Formula: C24H28N4OS MolecularWeight: 420.57032

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)SC2=NC(=NC(=C2)N3CCN(CC3)C)C4=CC=C(C=C4)C

Isomeric SMILES

CCOC1=CC=C(C=C1)SC2=NC(=NC(=C2)N3CCN(CC3)C)C4=CC=C(C=C4)C

InChI

InChI=1S/C24H28N4OS/c1-4-29-20-9-11-21(12-10-20)30-23-17-22(28-15-13-27(3)14-16-28)25-24(26-23)19-7-5-18(2)6-8-19/h5-12,17H,4,13-16H2,1-3H3