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

Systemtic Name: 2-(4-methoxyphenyl)-4-(4-methylpiperazin-1-yl)-6-(4-propoxyphenyl)sulfanyl-pyrimidine Openeye Name: 2-(4-methoxyphenyl)-4-(4-methylpiperazin-1-yl)-6-(4-propoxyphenyl)sulfanyl-pyrimidine CAS Name: 2-(4-methoxyphenyl)-4-(4-methyl-1-piperazinyl)-6-[(4-propoxyphenyl)thio]pyrimidine IUPAC Name: 2-(4-methoxyphenyl)-4-(4-methylpiperazin-1-yl)-6-(4-propoxyphenyl)sulfanylpyrimidine Traditional Name: 2-(4-methoxyphenyl)-4-(4-methylpiperazino)-6-[(4-propoxyphenyl)thio]pyrimidine Formula: C25H30N4O2S MolecularWeight: 450.5963

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)SC2=NC(=NC(=C2)N3CCN(CC3)C)C4=CC=C(C=C4)OC

Isomeric SMILES

CCCOC1=CC=C(C=C1)SC2=NC(=NC(=C2)N3CCN(CC3)C)C4=CC=C(C=C4)OC

InChI

InChI=1S/C25H30N4O2S/c1-4-17-31-21-9-11-22(12-10-21)32-24-18-23(29-15-13-28(2)14-16-29)26-25(27-24)19-5-7-20(30-3)8-6-19/h5-12,18H,4,13-17H2,1-3H3