N-[5-(benzotriazol-1-ylmethyl)-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: N-[5-(benzotriazol-1-ylmethyl)-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: N-[5-(benzotriazol-1-ylmethyl)-1,3,4-thiadiazol-2-yl]benzamide CAS Name: N-[5-(1-benzotriazolylmethyl)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: N-[5-(benzotriazol-1-ylmethyl)-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: N-[5-(benzotriazol-1-ylmethyl)-1,3,4-thiadiazol-2-yl]benzamide Formula: C16H12N6OS MolecularWeight: 336.37108

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12N6OS/c23-15(11-6-2-1-3-7-11)17-16-20-19-14(24-16)10-22-13-9-5-4-8-12(13)18-21-22/h1-9H,10H2,(H,17,20,23)