1-ethyl-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]benzotriazole-5-carboxamide

Systemtic Name: 1-ethyl-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]benzotriazole-5-carboxamide Openeye Name: 1-ethyl-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]benzotriazole-5-carboxamide CAS Name: 1-ethyl-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]-5-benzotriazolecarboxamide IUPAC Name: 1-ethyl-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]benzotriazole-5-carboxamide Traditional Name: 1-ethyl-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]benzotriazole-5-carboxamide Formula: C18H17N7O MolecularWeight: 347.37388

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)CN4C=NC=N4)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)CN4C=NC=N4)N=N1

InChI

InChI=1S/C18H17N7O/c1-2-25-17-8-5-14(9-16(17)22-23-25)18(26)21-15-6-3-13(4-7-15)10-24-12-19-11-20-24/h3-9,11-12H,2,10H2,1H3,(H,21,26)