N-(cyclopropylmethyl)-4-(2,3-dimethoxyphenyl)-1-(phenylsulfonyl)pyrrolidine-3-carboxamide

Systemtic Name: N-(cyclopropylmethyl)-4-(2,3-dimethoxyphenyl)-1-(phenylsulfonyl)pyrrolidine-3-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-(cyclopropylmethyl)-4-(2,3-dimethoxyphenyl)pyrrolidine-3-carboxamide CAS Name: 1-(benzenesulfonyl)-N-(cyclopropylmethyl)-4-(2,3-dimethoxyphenyl)-3-pyrrolidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-(cyclopropylmethyl)-4-(2,3-dimethoxyphenyl)pyrrolidine-3-carboxamide Traditional Name: 1-besyl-N-(cyclopropylmethyl)-4-(2,3-dimethoxyphenyl)pyrrolidine-3-carboxamide Formula: C23H28N2O5S MolecularWeight: 444.54382

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C2CN(CC2C(=O)NCC3CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1OC)C2CN(CC2C(=O)NCC3CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H28N2O5S/c1-29-21-10-6-9-18(22(21)30-2)19-14-25(31(27,28)17-7-4-3-5-8-17)15-20(19)23(26)24-13-16-11-12-16/h3-10,16,19-20H,11-15H2,1-2H3,(H,24,26)