N-(2-cyclopentylsulfanylphenyl)-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide

Systemtic Name: N-(2-cyclopentylsulfanylphenyl)-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide Openeye Name: N-(2-cyclopentylsulfanylphenyl)-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide CAS Name: N-[2-(cyclopentylthio)phenyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide IUPAC Name: N-(2-cyclopentylsulfanylphenyl)-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide Traditional Name: N-[2-(cyclopentylthio)phenyl]-1-mesyl-3,4-dihydro-2H-quinoline-6-carboxamide Formula: C22H26N2O3S2 MolecularWeight: 430.58344

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCC2=C1C=CC(=C2)C(=O)NC3=CC=CC=C3SC4CCCC4

Isomeric SMILES

CS(=O)(=O)N1CCCC2=C1C=CC(=C2)C(=O)NC3=CC=CC=C3SC4CCCC4

InChI

InChI=1S/C22H26N2O3S2/c1-29(26,27)24-14-6-7-16-15-17(12-13-20(16)24)22(25)23-19-10-4-5-11-21(19)28-18-8-2-3-9-18/h4-5,10-13,15,18H,2-3,6-9,14H2,1H3,(H,23,25)