2-[[6-(4-phenylbutan-2-ylcarbamoyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl]sulfanyl]ethanoic acid

Systemtic Name: 2-[[6-(4-phenylbutan-2-ylcarbamoyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl]sulfanyl]ethanoic acid Openeye Name: 2-[[6-[(1-methyl-3-phenyl-propyl)carbamoyl]-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl]sulfanyl]acetic acid CAS Name: 2-[[6-[oxo-(4-phenylbutan-2-ylamino)methyl]-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl]thio]acetic acid IUPAC Name: 2-[[6-(4-phenylbutan-2-ylcarbamoyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl]sulfanyl]acetic acid Traditional Name: 2-[[6-[(1-methyl-3-phenyl-propyl)carbamoyl]-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl]thio]acetic acid Formula: C25H26N2O3S MolecularWeight: 434.55054

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(=O)C2=CC3=C(C=C2)C(=C4CCCC4=N3)SCC(=O)O

Isomeric SMILES

CC(CCC1=CC=CC=C1)NC(=O)C2=CC3=C(C=C2)C(=C4CCCC4=N3)SCC(=O)O

InChI

InChI=1S/C25H26N2O3S/c1-16(10-11-17-6-3-2-4-7-17)26-25(30)18-12-13-20-22(14-18)27-21-9-5-8-19(21)24(20)31-15-23(28)29/h2-4,6-7,12-14,16H,5,8-11,15H2,1H3,(H,26,30)(H,28,29)