[2-(3,3-diphenylpropylamino)-2-oxidanylidene-ethyl] 3-methyl-5-(methylamino)-1,2-thiazole-4-carboxylate

Systemtic Name: [2-(3,3-diphenylpropylamino)-2-oxidanylidene-ethyl] 3-methyl-5-(methylamino)-1,2-thiazole-4-carboxylate Openeye Name: [2-(3,3-diphenylpropylamino)-2-oxo-ethyl] 3-methyl-5-(methylamino)isothiazole-4-carboxylate CAS Name: 3-methyl-5-(methylamino)-4-isothiazolecarboxylic acid [2-(3,3-diphenylpropylamino)-2-oxoethyl] ester IUPAC Name: [2-(3,3-diphenylpropylamino)-2-oxoethyl] 3-methyl-5-(methylamino)-1,2-thiazole-4-carboxylate Traditional Name: 3-methyl-5-(methylamino)isothiazole-4-carboxylic acid [2-(3,3-diphenylpropylamino)-2-keto-ethyl] ester Formula: C23H25N3O3S MolecularWeight: 423.5279

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NSC(=C1C(=O)OCC(=O)NCCC(C2=CC=CC=C2)C3=CC=CC=C3)NC

Isomeric SMILES

CC1=NSC(=C1C(=O)OCC(=O)NCCC(C2=CC=CC=C2)C3=CC=CC=C3)NC

InChI

InChI=1S/C23H25N3O3S/c1-16-21(22(24-2)30-26-16)23(28)29-15-20(27)25-14-13-19(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-12,19,24H,13-15H2,1-2H3,(H,25,27)