methyl 1-[4-[methyl(thiophen-2-ylsulfonyl)amino]butanoyl]-3,4-dihydro-2H-quinoline-5-carboxylate

Systemtic Name: methyl 1-[4-[methyl(thiophen-2-ylsulfonyl)amino]butanoyl]-3,4-dihydro-2H-quinoline-5-carboxylate Openeye Name: methyl 1-[4-[methyl(2-thienylsulfonyl)amino]butanoyl]-3,4-dihydro-2H-quinoline-5-carboxylate CAS Name: 1-[4-[methyl(thiophen-2-ylsulfonyl)amino]-1-oxobutyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid methyl ester IUPAC Name: methyl 1-[4-[methyl(thiophen-2-ylsulfonyl)amino]butanoyl]-3,4-dihydro-2H-quinoline-5-carboxylate Traditional Name: 1-[4-[methyl(2-thienylsulfonyl)amino]butanoyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid methyl ester Formula: C20H24N2O5S2 MolecularWeight: 436.54496

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)N1CCCC2=C(C=CC=C21)C(=O)OC)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CN(CCCC(=O)N1CCCC2=C(C=CC=C21)C(=O)OC)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C20H24N2O5S2/c1-21(29(25,26)19-11-6-14-28-19)12-5-10-18(23)22-13-4-8-15-16(20(24)27-2)7-3-9-17(15)22/h3,6-7,9,11,14H,4-5,8,10,12-13H2,1-2H3