[2-[cyclohexylmethyl-[5-[(2-oxidanylidene-1H-quinolin-6-yl)oxy]pentanoyl]amino]-4-methylsulfanyl-butyl] ethanoate

Systemtic Name: [2-[cyclohexylmethyl-[5-[(2-oxidanylidene-1H-quinolin-6-yl)oxy]pentanoyl]amino]-4-methylsulfanyl-butyl] ethanoate Openeye Name: [2-[cyclohexylmethyl-[5-[(2-oxo-1H-quinolin-6-yl)oxy]pentanoyl]amino]-4-methylsulfanyl-butyl] acetate CAS Name: acetic acid [2-[cyclohexylmethyl-[1-oxo-5-[(2-oxo-1H-quinolin-6-yl)oxy]pentyl]amino]-4-(methylthio)butyl] ester IUPAC Name: [2-[cyclohexylmethyl-[5-[(2-oxo-1H-quinolin-6-yl)oxy]pentanoyl]amino]-4-methylsulfanylbutyl] acetate Traditional Name: acetic acid [2-[cyclohexylmethyl-[5-[(2-keto-1H-quinolin-6-yl)oxy]pentanoyl]amino]-4-(methylthio)butyl] ester Formula: C28H40N2O5S MolecularWeight: 516.6926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(CCSC)N(CC1CCCCC1)C(=O)CCCCOC2=CC3=C(C=C2)NC(=O)C=C3

Isomeric SMILES

CC(=O)OCC(CCSC)N(CC1CCCCC1)C(=O)CCCCOC2=CC3=C(C=C2)NC(=O)C=C3

InChI

InChI=1S/C28H40N2O5S/c1-21(31)35-20-24(15-17-36-2)30(19-22-8-4-3-5-9-22)28(33)10-6-7-16-34-25-12-13-26-23(18-25)11-14-27(32)29-26/h11-14,18,22,24H,3-10,15-17,19-20H2,1-2H3,(H,29,32)