ethyl 4-[2-(1,3-benzothiazol-2-yl)-2-cyano-ethenyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-(1,3-benzothiazol-2-yl)-2-cyano-ethenyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-(1,3-benzothiazol-2-yl)-2-cyano-vinyl]piperazine-1-carboxylate CAS Name: 4-[2-(1,3-benzothiazol-2-yl)-2-cyanoethenyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(1,3-benzothiazol-2-yl)-2-cyanoethenyl]piperazine-1-carboxylate Traditional Name: 4-[2-(1,3-benzothiazol-2-yl)-2-cyano-vinyl]piperazine-1-carboxylic acid ethyl ester Formula: C17H18N4O2S MolecularWeight: 342.41542

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C=C(C#N)C2=NC3=CC=CC=C3S2

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C=C(C#N)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H18N4O2S/c1-2-23-17(22)21-9-7-20(8-10-21)12-13(11-18)16-19-14-5-3-4-6-15(14)24-16/h3-6,12H,2,7-10H2,1H3