S-[cyclohexyl(methyl)amino] 4-[(2-sulfanylidene-1H-quinolin-6-yl)oxy]butanethioate

Systemtic Name: S-[cyclohexyl(methyl)amino] 4-[(2-sulfanylidene-1H-quinolin-6-yl)oxy]butanethioate Openeye Name: S-[cyclohexyl(methyl)amino] 4-[(2-thioxo-1H-quinolin-6-yl)oxy]butanethioate CAS Name: 4-[(2-sulfanylidene-1H-quinolin-6-yl)oxy]butanethioic acid S-[cyclohexyl(methyl)amino] ester IUPAC Name: S-[cyclohexyl(methyl)amino] 4-[(2-sulfanylidene-1H-quinolin-6-yl)oxy]butanethioate Traditional Name: 4-[(2-thioxo-1H-quinolin-6-yl)oxy]butanethioic acid S-[cyclohexyl(methyl)amino] ester Formula: C20H26N2O2S2 MolecularWeight: 390.56264

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)SC(=O)CCCOC2=CC3=C(C=C2)NC(=S)C=C3

Isomeric SMILES

CN(C1CCCCC1)SC(=O)CCCOC2=CC3=C(C=C2)NC(=S)C=C3

InChI

InChI=1S/C20H26N2O2S2/c1-22(16-6-3-2-4-7-16)26-20(23)8-5-13-24-17-10-11-18-15(14-17)9-12-19(25)21-18/h9-12,14,16H,2-8,13H2,1H3,(H,21,25)