ethyl 4-(4-cyano-5-phenylazanyl-1,2-thiazol-3-yl)piperazine-1-carboxylate

Systemtic Name: ethyl 4-(4-cyano-5-phenylazanyl-1,2-thiazol-3-yl)piperazine-1-carboxylate Openeye Name: ethyl 4-(5-anilino-4-cyano-isothiazol-3-yl)piperazine-1-carboxylate CAS Name: 4-(5-anilino-4-cyano-3-isothiazolyl)-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(5-anilino-4-cyano-1,2-thiazol-3-yl)piperazine-1-carboxylate Traditional Name: 4-(5-anilino-4-cyano-isothiazol-3-yl)piperazine-1-carboxylic acid ethyl ester Formula: C17H19N5O2S MolecularWeight: 357.43006

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=NSC(=C2C#N)NC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=NSC(=C2C#N)NC3=CC=CC=C3

InChI

InChI=1S/C17H19N5O2S/c1-2-24-17(23)22-10-8-21(9-11-22)15-14(12-18)16(25-20-15)19-13-6-4-3-5-7-13/h3-7,19H,2,8-11H2,1H3