ethyl 4-[2-[(6-ethyl-5-phenyl-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[(6-ethyl-5-phenyl-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[(6-ethyl-5-phenyl-1,3-benzothiazol-2-yl)amino]-2-oxo-ethyl]piperazine-1-carboxylate CAS Name: 4-[2-[(6-ethyl-5-phenyl-1,3-benzothiazol-2-yl)amino]-2-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[(6-ethyl-5-phenyl-1,3-benzothiazol-2-yl)amino]-2-oxoethyl]piperazine-1-carboxylate Traditional Name: 4-[2-[(6-ethyl-5-phenyl-1,3-benzothiazol-2-yl)amino]-2-keto-ethyl]piperazine-1-carboxylic acid ethyl ester Formula: C24H28N4O3S MolecularWeight: 452.56912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1C3=CC=CC=C3)N=C(S2)NC(=O)CN4CCN(CC4)C(=O)OCC

Isomeric SMILES

CCC1=CC2=C(C=C1C3=CC=CC=C3)N=C(S2)NC(=O)CN4CCN(CC4)C(=O)OCC

InChI

InChI=1S/C24H28N4O3S/c1-3-17-14-21-20(15-19(17)18-8-6-5-7-9-18)25-23(32-21)26-22(29)16-27-10-12-28(13-11-27)24(30)31-4-2/h5-9,14-15H,3-4,10-13,16H2,1-2H3,(H,25,26,29)