[3-[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl-4-methoxy-phenyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: [3-[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl-4-methoxy-phenyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: [3-[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl-4-methoxy-phenyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: [3-[[4-(3-chlorophenyl)-1-piperazinyl]sulfonyl]-4-methoxyphenyl]-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: [3-[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl-4-methoxyphenyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: [3-[4-(3-chlorophenyl)piperazino]sulfonyl-4-methoxy-phenyl]-[4-(2-pyrimidyl)piperazino]methanone Formula: C26H29ClN6O4S MolecularWeight: 557.06426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=NC=CC=N3)S(=O)(=O)N4CCN(CC4)C5=CC(=CC=C5)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=NC=CC=N3)S(=O)(=O)N4CCN(CC4)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C26H29ClN6O4S/c1-37-23-7-6-20(25(34)31-10-12-32(13-11-31)26-28-8-3-9-29-26)18-24(23)38(35,36)33-16-14-30(15-17-33)22-5-2-4-21(27)19-22/h2-9,18-19H,10-17H2,1H3