5-(benzotriazol-1-ylmethyl)-N-[(E)-(phenylmethylidene)amino]-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-(benzotriazol-1-ylmethyl)-N-[(E)-(phenylmethylidene)amino]-1,3,4-thiadiazol-2-amine Openeye Name: 5-(benzotriazol-1-ylmethyl)-N-[(E)-benzylideneamino]-1,3,4-thiadiazol-2-amine CAS Name: 5-(1-benzotriazolylmethyl)-N-[(E)-(phenylmethylene)amino]-1,3,4-thiadiazol-2-amine IUPAC Name: 5-(benzotriazol-1-ylmethyl)-N-[(E)-benzylideneamino]-1,3,4-thiadiazol-2-amine Traditional Name: [(E)-benzalamino]-[5-(benzotriazol-1-ylmethyl)-1,3,4-thiadiazol-2-yl]amine Formula: C16H13N7S MolecularWeight: 335.38632

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=NNC2=NN=C(S2)CN3C4=CC=CC=C4N=N3

Isomeric SMILES

C1=CC=C(C=C1)/C=N/NC2=NN=C(S2)CN3C4=CC=CC=C4N=N3

InChI

InChI=1S/C16H13N7S/c1-2-6-12(7-3-1)10-17-20-16-21-19-15(24-16)11-23-14-9-5-4-8-13(14)18-22-23/h1-10H,11H2,(H,20,21)/b17-10+