5-azanyl-1-(3-bromophenyl)-N-[(1S)-1-phenylethyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: 5-azanyl-1-(3-bromophenyl)-N-[(1S)-1-phenylethyl]-1,2,3-triazole-4-carboxamide Openeye Name: 5-amino-1-(3-bromophenyl)-N-[(1S)-1-phenylethyl]triazole-4-carboxamide CAS Name: 5-amino-1-(3-bromophenyl)-N-[(1S)-1-phenylethyl]-4-triazolecarboxamide IUPAC Name: 5-amino-1-(3-bromophenyl)-N-[(1S)-1-phenylethyl]triazole-4-carboxamide Traditional Name: 5-amino-1-(3-bromophenyl)-N-[(1S)-1-phenylethyl]triazole-4-carboxamide Formula: C17H16BrN5O MolecularWeight: 386.24584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2=C(N(N=N2)C3=CC(=CC=C3)Br)N

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)NC(=O)C2=C(N(N=N2)C3=CC(=CC=C3)Br)N

InChI

InChI=1S/C17H16BrN5O/c1-11(12-6-3-2-4-7-12)20-17(24)15-16(19)23(22-21-15)14-9-5-8-13(18)10-14/h2-11H,19H2,1H3,(H,20,24)/t11-/m0/s1