2-(benzotriazol-1-yl)-N-[(Z)-[1-(2-cyanoethyl)indol-3-yl]methylideneamino]ethanamide

Systemtic Name: 2-(benzotriazol-1-yl)-N-[(Z)-[1-(2-cyanoethyl)indol-3-yl]methylideneamino]ethanamide Openeye Name: 2-(benzotriazol-1-yl)-N-[(Z)-[1-(2-cyanoethyl)indol-3-yl]methyleneamino]acetamide CAS Name: 2-(1-benzotriazolyl)-N-[(Z)-[1-(2-cyanoethyl)-3-indolyl]methylideneamino]acetamide IUPAC Name: 2-(benzotriazol-1-yl)-N-[(Z)-[1-(2-cyanoethyl)indol-3-yl]methylideneamino]acetamide Traditional Name: 2-(benzotriazol-1-yl)-N-[(Z)-[1-(2-cyanoethyl)indol-3-yl]methyleneamino]acetamide Formula: C20H17N7O MolecularWeight: 371.39528

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2CCC#N)C=NNC(=O)CN3C4=CC=CC=C4N=N3

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2CCC#N)/C=N\NC(=O)CN3C4=CC=CC=C4N=N3

InChI

InChI=1S/C20H17N7O/c21-10-5-11-26-13-15(16-6-1-3-8-18(16)26)12-22-24-20(28)14-27-19-9-4-2-7-17(19)23-25-27/h1-4,6-9,12-13H,5,11,14H2,(H,24,28)/b22-12-