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

Systemtic Name: S-[2-[(4-dimethylaminophenyl)amino]-2-oxidanylidene-ethyl] 6-methyl-3,4-dihydro-2H-quinoline-1-carbothioate Openeye Name: S-[2-[4-(dimethylamino)anilino]-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-(dimethylamino)anilino]-2-oxoethyl] ester IUPAC Name: S-[2-[4-(dimethylamino)anilino]-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-(dimethylamino)anilino]-2-keto-ethyl] ester Formula: C21H25N3O2S MolecularWeight: 383.5071

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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)N(C)C

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O2S/c1-15-6-11-19-16(13-15)5-4-12-24(19)21(26)27-14-20(25)22-17-7-9-18(10-8-17)23(2)3/h6-11,13H,4-5,12,14H2,1-3H3,(H,22,25)