(11E)-11-(phenylmethylidene)-1,2,3,6-tetrahydropyrazolo[1,2-c][1,3,4]benzotriazepine-5-thione

Systemtic Name: (11E)-11-(phenylmethylidene)-1,2,3,6-tetrahydropyrazolo[1,2-c][1,3,4]benzotriazepine-5-thione Openeye Name: (11E)-11-benzylidene-1,2,3,6-tetrahydropyrazolo[1,2-c][1,3,4]benzotriazepine-5-thione CAS Name: (11E)-11-(phenylmethylene)-1,2,3,6-tetrahydropyrazolo[1,2-c][1,3,4]benzotriazepine-5-thione IUPAC Name: (11E)-11-benzylidene-1,2,3,6-tetrahydropyrazolo[1,2-c][1,3,4]benzotriazepine-5-thione Traditional Name: (11E)-11-benzal-1,2,3,6-tetrahydropyrazolo[1,2-c][1,3,4]benzotriazepine-5-thione Formula: C18H17N3S MolecularWeight: 307.41268

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2C(=CC3=CC=CC=C3)C4=CC=CC=C4NC(=S)N2C1

Isomeric SMILES

C1CN2/C(=C/C3=CC=CC=C3)/C4=CC=CC=C4NC(=S)N2C1

InChI

InChI=1S/C18H17N3S/c22-18-19-16-10-5-4-9-15(16)17(20-11-6-12-21(18)20)13-14-7-2-1-3-8-14/h1-5,7-10,13H,6,11-12H2,(H,19,22)/b17-13+