(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]methanone

Systemtic Name: (2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]methanone Openeye Name: (2-chloro-5-pyrrolidin-1-ylsulfonyl-phenyl)-[3-methyl-4-(m-tolyl)piperazin-1-yl]methanone CAS Name: [2-chloro-5-(1-pyrrolidinylsulfonyl)phenyl]-[3-methyl-4-(3-methylphenyl)-1-piperazinyl]methanone IUPAC Name: (2-chloro-5-pyrrolidin-1-ylsulfonylphenyl)-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]methanone Traditional Name: (2-chloro-5-pyrrolidinosulfonyl-phenyl)-[3-methyl-4-(m-tolyl)piperazino]methanone Formula: C23H28ClN3O3S MolecularWeight: 462.00472

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC=CC(=C2)C)C(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCC4)Cl

Isomeric SMILES

CC1CN(CCN1C2=CC=CC(=C2)C)C(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCC4)Cl

InChI

InChI=1S/C23H28ClN3O3S/c1-17-6-5-7-19(14-17)27-13-12-25(16-18(27)2)23(28)21-15-20(8-9-22(21)24)31(29,30)26-10-3-4-11-26/h5-9,14-15,18H,3-4,10-13,16H2,1-2H3