5-azanyl-1-[2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl]-N-phenethyl-1,2,3-triazole-4-carboxamide

Systemtic Name: 5-azanyl-1-[2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl]-N-phenethyl-1,2,3-triazole-4-carboxamide Openeye Name: 5-amino-1-[2-(4-chloroanilino)-2-oxo-ethyl]-N-phenethyl-triazole-4-carboxamide CAS Name: 5-amino-1-[2-(4-chloroanilino)-2-oxoethyl]-N-phenethyl-4-triazolecarboxamide IUPAC Name: 5-amino-1-[2-(4-chloroanilino)-2-oxoethyl]-N-phenethyltriazole-4-carboxamide Traditional Name: 5-amino-1-[2-(4-chloroanilino)-2-keto-ethyl]-N-phenethyl-triazole-4-carboxamide Formula: C19H19ClN6O2 MolecularWeight: 398.84616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)C2=C(N(N=N2)CC(=O)NC3=CC=C(C=C3)Cl)N

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)C2=C(N(N=N2)CC(=O)NC3=CC=C(C=C3)Cl)N

InChI

InChI=1S/C19H19ClN6O2/c20-14-6-8-15(9-7-14)23-16(27)12-26-18(21)17(24-25-26)19(28)22-11-10-13-4-2-1-3-5-13/h1-9H,10-12,21H2,(H,22,28)(H,23,27)