(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-[4-(2-methoxyphenyl)piperazin-1-yl]methanone

Systemtic Name: (2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-[4-(2-methoxyphenyl)piperazin-1-yl]methanone Openeye Name: (2-chloro-5-pyrrolidin-1-ylsulfonyl-phenyl)-[4-(2-methoxyphenyl)piperazin-1-yl]methanone CAS Name: [2-chloro-5-(1-pyrrolidinylsulfonyl)phenyl]-[4-(2-methoxyphenyl)-1-piperazinyl]methanone IUPAC Name: (2-chloro-5-pyrrolidin-1-ylsulfonylphenyl)-[4-(2-methoxyphenyl)piperazin-1-yl]methanone Traditional Name: (2-chloro-5-pyrrolidinosulfonyl-phenyl)-[4-(2-methoxyphenyl)piperazino]methanone Formula: C22H26ClN3O4S MolecularWeight: 463.97754

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCC4)Cl

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCC4)Cl

InChI

InChI=1S/C22H26ClN3O4S/c1-30-21-7-3-2-6-20(21)24-12-14-25(15-13-24)22(27)18-16-17(8-9-19(18)23)31(28,29)26-10-4-5-11-26/h2-3,6-9,16H,4-5,10-15H2,1H3