4-[4-(4-methoxy-3-methyl-phenyl)sulfonylpiperazin-1-yl]-2-methyl-6-propoxy-pyrimidine

Systemtic Name: 4-[4-(4-methoxy-3-methyl-phenyl)sulfonylpiperazin-1-yl]-2-methyl-6-propoxy-pyrimidine Openeye Name: 4-[4-(4-methoxy-3-methyl-phenyl)sulfonylpiperazin-1-yl]-2-methyl-6-propoxy-pyrimidine CAS Name: 4-[4-(4-methoxy-3-methylphenyl)sulfonyl-1-piperazinyl]-2-methyl-6-propoxypyrimidine IUPAC Name: 4-[4-(4-methoxy-3-methylphenyl)sulfonylpiperazin-1-yl]-2-methyl-6-propoxypyrimidine Traditional Name: 4-[4-(4-methoxy-3-methyl-phenyl)sulfonylpiperazino]-2-methyl-6-propoxy-pyrimidine Formula: C20H28N4O4S MolecularWeight: 420.52572

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=NC(=NC(=C1)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)OC)C)C

Isomeric SMILES

CCCOC1=NC(=NC(=C1)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)OC)C)C

InChI

InChI=1S/C20H28N4O4S/c1-5-12-28-20-14-19(21-16(3)22-20)23-8-10-24(11-9-23)29(25,26)17-6-7-18(27-4)15(2)13-17/h6-7,13-14H,5,8-12H2,1-4H3