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

Systemtic Name: 4-[4-(4-methoxy-2,3-dimethyl-phenyl)sulfonylpiperazin-1-yl]-2-methyl-6-pyrazol-1-yl-pyrimidine Openeye Name: 4-[4-(4-methoxy-2,3-dimethyl-phenyl)sulfonylpiperazin-1-yl]-2-methyl-6-pyrazol-1-yl-pyrimidine CAS Name: 4-[4-(4-methoxy-2,3-dimethylphenyl)sulfonyl-1-piperazinyl]-2-methyl-6-(1-pyrazolyl)pyrimidine IUPAC Name: 4-[4-(4-methoxy-2,3-dimethylphenyl)sulfonylpiperazin-1-yl]-2-methyl-6-pyrazol-1-ylpyrimidine Traditional Name: 4-[4-(4-methoxy-2,3-dimethyl-phenyl)sulfonylpiperazino]-2-methyl-6-pyrazol-1-yl-pyrimidine Formula: C21H26N6O3S MolecularWeight: 442.53454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C)S(=O)(=O)N2CCN(CC2)C3=NC(=NC(=C3)N4C=CC=N4)C)OC

Isomeric SMILES

CC1=C(C=CC(=C1C)S(=O)(=O)N2CCN(CC2)C3=NC(=NC(=C3)N4C=CC=N4)C)OC

InChI

InChI=1S/C21H26N6O3S/c1-15-16(2)19(7-6-18(15)30-4)31(28,29)26-12-10-25(11-13-26)20-14-21(24-17(3)23-20)27-9-5-8-22-27/h5-9,14H,10-13H2,1-4H3