4-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]-6-ethoxy-2-methyl-pyrimidine

Systemtic Name: 4-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]-6-ethoxy-2-methyl-pyrimidine Openeye Name: 4-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]-6-ethoxy-2-methyl-pyrimidine CAS Name: 4-[4-(3-chlorophenyl)sulfonyl-1-piperazinyl]-6-ethoxy-2-methylpyrimidine IUPAC Name: 4-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]-6-ethoxy-2-methylpyrimidine Traditional Name: 4-[4-(3-chlorophenyl)sulfonylpiperazino]-6-ethoxy-2-methyl-pyrimidine Formula: C17H21ClN4O3S MolecularWeight: 396.89164

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC(=NC(=C1)N2CCN(CC2)S(=O)(=O)C3=CC(=CC=C3)Cl)C

Isomeric SMILES

CCOC1=NC(=NC(=C1)N2CCN(CC2)S(=O)(=O)C3=CC(=CC=C3)Cl)C

InChI

InChI=1S/C17H21ClN4O3S/c1-3-25-17-12-16(19-13(2)20-17)21-7-9-22(10-8-21)26(23,24)15-6-4-5-14(18)11-15/h4-6,11-12H,3,7-10H2,1-2H3