5-azanyl-1-[[3,5-bis(chloranyl)-4-naphthalen-1-ylcarbonyl-phenyl]methyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: 5-azanyl-1-[[3,5-bis(chloranyl)-4-naphthalen-1-ylcarbonyl-phenyl]methyl]-1,2,3-triazole-4-carboxamide Openeye Name: 5-amino-1-[[3,5-dichloro-4-(naphthalene-1-carbonyl)phenyl]methyl]triazole-4-carboxamide CAS Name: 5-amino-1-[[3,5-dichloro-4-[1-naphthalenyl(oxo)methyl]phenyl]methyl]-4-triazolecarboxamide IUPAC Name: 5-amino-1-[[3,5-dichloro-4-(naphthalene-1-carbonyl)phenyl]methyl]triazole-4-carboxamide Traditional Name: 5-amino-1-[3,5-dichloro-4-(1-naphthoyl)benzyl]triazole-4-carboxamide Formula: C21H15Cl2N5O2 MolecularWeight: 440.2821

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2C(=O)C3=C(C=C(C=C3Cl)CN4C(=C(N=N4)C(=O)N)N)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2C(=O)C3=C(C=C(C=C3Cl)CN4C(=C(N=N4)C(=O)N)N)Cl

InChI

InChI=1S/C21H15Cl2N5O2/c22-15-8-11(10-28-20(24)18(21(25)30)26-27-28)9-16(23)17(15)19(29)14-7-3-5-12-4-1-2-6-13(12)14/h1-9H,10,24H2,(H2,25,30)