N-(6-ethyl-1,3-benzothiazol-2-yl)-1-(phenylmethyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-1-(phenylmethyl)-1,2,3-triazole-4-carboxamide Openeye Name: 1-benzyl-N-(6-ethyl-1,3-benzothiazol-2-yl)triazole-4-carboxamide CAS Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-1-(phenylmethyl)-4-triazolecarboxamide IUPAC Name: 1-benzyl-N-(6-ethyl-1,3-benzothiazol-2-yl)triazole-4-carboxamide Traditional Name: 1-benzyl-N-(6-ethyl-1,3-benzothiazol-2-yl)triazole-4-carboxamide Formula: C19H17N5OS MolecularWeight: 363.43618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CN(N=N3)CC4=CC=CC=C4

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CN(N=N3)CC4=CC=CC=C4

InChI

InChI=1S/C19H17N5OS/c1-2-13-8-9-15-17(10-13)26-19(20-15)21-18(25)16-12-24(23-22-16)11-14-6-4-3-5-7-14/h3-10,12H,2,11H2,1H3,(H,20,21,25)