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

Systemtic Name: N-[5-(benzotriazol-1-ylmethyl)-1,3,4-thiadiazol-2-yl]-N-ethyl-3,4,5-trimethoxy-benzamide Openeye Name: N-[5-(benzotriazol-1-ylmethyl)-1,3,4-thiadiazol-2-yl]-N-ethyl-3,4,5-trimethoxy-benzamide CAS Name: N-[5-(1-benzotriazolylmethyl)-1,3,4-thiadiazol-2-yl]-N-ethyl-3,4,5-trimethoxybenzamide IUPAC Name: N-[5-(benzotriazol-1-ylmethyl)-1,3,4-thiadiazol-2-yl]-N-ethyl-3,4,5-trimethoxybenzamide Traditional Name: N-[5-(benzotriazol-1-ylmethyl)-1,3,4-thiadiazol-2-yl]-N-ethyl-3,4,5-trimethoxy-benzamide Formula: C21H22N6O4S MolecularWeight: 454.50218

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N6O4S/c1-5-26(20(28)13-10-16(29-2)19(31-4)17(11-13)30-3)21-24-23-18(32-21)12-27-15-9-7-6-8-14(15)22-25-27/h6-11H,5,12H2,1-4H3