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

Systemtic Name: N-[5-(benzotriazol-1-ylmethyl)-1,3,4-thiadiazol-2-yl]-N-(2-oxidanylidenepropyl)benzamide Openeye Name: N-acetonyl-N-[5-(benzotriazol-1-ylmethyl)-1,3,4-thiadiazol-2-yl]benzamide CAS Name: N-[5-(1-benzotriazolylmethyl)-1,3,4-thiadiazol-2-yl]-N-(2-oxopropyl)benzamide IUPAC Name: N-[5-(benzotriazol-1-ylmethyl)-1,3,4-thiadiazol-2-yl]-N-(2-oxopropyl)benzamide Traditional Name: N-acetonyl-N-[5-(benzotriazol-1-ylmethyl)-1,3,4-thiadiazol-2-yl]benzamide Formula: C19H16N6O2S MolecularWeight: 392.43434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CN(C1=NN=C(S1)CN2C3=CC=CC=C3N=N2)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC(=O)CN(C1=NN=C(S1)CN2C3=CC=CC=C3N=N2)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C19H16N6O2S/c1-13(26)11-24(18(27)14-7-3-2-4-8-14)19-22-21-17(28-19)12-25-16-10-6-5-9-15(16)20-23-25/h2-10H,11-12H2,1H3