S-[2-(2H-benzotriazol-5-ylamino)-2-oxidanylidene-ethyl] 6-methyl-3,4-dihydro-2H-quinoline-1-carbothioate

Systemtic Name: S-[2-(2H-benzotriazol-5-ylamino)-2-oxidanylidene-ethyl] 6-methyl-3,4-dihydro-2H-quinoline-1-carbothioate Openeye Name: S-[2-(2H-benzotriazol-5-ylamino)-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-(2H-benzotriazol-5-ylamino)-2-oxoethyl] ester IUPAC Name: S-[2-(2H-benzotriazol-5-ylamino)-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-(2H-benzotriazol-5-ylamino)-2-keto-ethyl] ester Formula: C19H19N5O2S MolecularWeight: 381.45146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(CCC2)C(=O)SCC(=O)NC3=CC4=NNN=C4C=C3

Isomeric SMILES

CC1=CC2=C(C=C1)N(CCC2)C(=O)SCC(=O)NC3=CC4=NNN=C4C=C3

InChI

InChI=1S/C19H19N5O2S/c1-12-4-7-17-13(9-12)3-2-8-24(17)19(26)27-11-18(25)20-14-5-6-15-16(10-14)22-23-21-15/h4-7,9-10H,2-3,8,11H2,1H3,(H,20,25)(H,21,22,23)