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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16BrN5O/c1-11(12-5-3-2-4-6-12)20-17(24)15-16(19)23(22-21-15)14-9-7-13(18)8-10-14/h2-11H,19H2,1H3,(H,20,24)/t11-/m1/s1