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

Systemtic Name: ethyl 4-[2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-2-oxo-acetyl]piperazine-1-carboxylate CAS Name: 4-[2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-1,2-dioxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-2-oxoacetyl]piperazine-1-carboxylate Traditional Name: 4-[2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-2-keto-acetyl]piperazine-1-carboxylic acid ethyl ester Formula: C18H22N4O5S MolecularWeight: 406.45608

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C(=O)N3CCN(CC3)C(=O)OCC

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C(=O)N3CCN(CC3)C(=O)OCC

InChI

InChI=1S/C18H22N4O5S/c1-3-26-12-5-6-13-14(11-12)28-17(19-13)20-15(23)16(24)21-7-9-22(10-8-21)18(25)27-4-2/h5-6,11H,3-4,7-10H2,1-2H3,(H,19,20,23)