(2S)-N-(4-methoxyphenyl)-1-quinolin-8-ylsulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-(4-methoxyphenyl)-1-quinolin-8-ylsulfonyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-N-(4-methoxyphenyl)-1-(8-quinolylsulfonyl)pyrrolidine-2-carboxamide CAS Name: (2S)-N-(4-methoxyphenyl)-1-(8-quinolinylsulfonyl)-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-(4-methoxyphenyl)-1-quinolin-8-ylsulfonylpyrrolidine-2-carboxamide Traditional Name: (2S)-N-(4-methoxyphenyl)-1-(8-quinolylsulfonyl)pyrrolidine-2-carboxamide Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2CCCN2S(=O)(=O)C3=CC=CC4=C3N=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)[C@@H]2CCCN2S(=O)(=O)C3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C21H21N3O4S/c1-28-17-11-9-16(10-12-17)23-21(25)18-7-4-14-24(18)29(26,27)19-8-2-5-15-6-3-13-22-20(15)19/h2-3,5-6,8-13,18H,4,7,14H2,1H3,(H,23,25)/t18-/m0/s1