S-[2-[(4-cyclohexylphenyl)amino]-2-oxidanylidene-ethyl] 6-methyl-3,4-dihydro-2H-quinoline-1-carbothioate

Systemtic Name: S-[2-[(4-cyclohexylphenyl)amino]-2-oxidanylidene-ethyl] 6-methyl-3,4-dihydro-2H-quinoline-1-carbothioate Openeye Name: S-[2-(4-cyclohexylanilino)-2-oxo-ethyl] 6-methyl-3,4-dihydro-2H-quinoline-1-carbothioate CAS Name: 6-methyl-3,4-dihydro-2H-quinoline-1-carbothioic acid S-[2-(4-cyclohexylanilino)-2-oxoethyl] ester IUPAC Name: S-[2-(4-cyclohexylanilino)-2-oxoethyl] 6-methyl-3,4-dihydro-2H-quinoline-1-carbothioate Traditional Name: 6-methyl-3,4-dihydro-2H-quinoline-1-carbothioic acid S-[2-(4-cyclohexylanilino)-2-keto-ethyl] ester Formula: C25H30N2O2S MolecularWeight: 422.5829

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(CCC2)C(=O)SCC(=O)NC3=CC=C(C=C3)C4CCCCC4

Isomeric SMILES

CC1=CC2=C(C=C1)N(CCC2)C(=O)SCC(=O)NC3=CC=C(C=C3)C4CCCCC4

InChI

InChI=1S/C25H30N2O2S/c1-18-9-14-23-21(16-18)8-5-15-27(23)25(29)30-17-24(28)26-22-12-10-20(11-13-22)19-6-3-2-4-7-19/h9-14,16,19H,2-8,15,17H2,1H3,(H,26,28)