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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCC4)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCC4)Cl

InChI

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