N-[2,4-bis(chloranyl)-3-methyl-phenyl]-1-(phenylsulfonyl)pyrrolidine-2-carboxamide

Systemtic Name: N-[2,4-bis(chloranyl)-3-methyl-phenyl]-1-(phenylsulfonyl)pyrrolidine-2-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-(2,4-dichloro-3-methyl-phenyl)pyrrolidine-2-carboxamide CAS Name: 1-(benzenesulfonyl)-N-(2,4-dichloro-3-methylphenyl)-2-pyrrolidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-(2,4-dichloro-3-methylphenyl)pyrrolidine-2-carboxamide Traditional Name: 1-besyl-N-(2,4-dichloro-3-methyl-phenyl)pyrrolidine-2-carboxamide Formula: C18H18Cl2N2O3S MolecularWeight: 413.31812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1Cl)NC(=O)C2CCCN2S(=O)(=O)C3=CC=CC=C3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1Cl)NC(=O)C2CCCN2S(=O)(=O)C3=CC=CC=C3)Cl

InChI

InChI=1S/C18H18Cl2N2O3S/c1-12-14(19)9-10-15(17(12)20)21-18(23)16-8-5-11-22(16)26(24,25)13-6-3-2-4-7-13/h2-4,6-7,9-10,16H,5,8,11H2,1H3,(H,21,23)