5-azanyl-1-(3-bromophenyl)-N-(3-chloranyl-4-methoxy-phenyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: 5-azanyl-1-(3-bromophenyl)-N-(3-chloranyl-4-methoxy-phenyl)-1,2,3-triazole-4-carboxamide Openeye Name: 5-amino-1-(3-bromophenyl)-N-(3-chloro-4-methoxy-phenyl)triazole-4-carboxamide CAS Name: 5-amino-1-(3-bromophenyl)-N-(3-chloro-4-methoxyphenyl)-4-triazolecarboxamide IUPAC Name: 5-amino-1-(3-bromophenyl)-N-(3-chloro-4-methoxyphenyl)triazole-4-carboxamide Traditional Name: 5-amino-1-(3-bromophenyl)-N-(3-chloro-4-methoxy-phenyl)triazole-4-carboxamide Formula: C16H13BrClN5O2 MolecularWeight: 422.66372

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2=C(N(N=N2)C3=CC(=CC=C3)Br)N)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2=C(N(N=N2)C3=CC(=CC=C3)Br)N)Cl

InChI

InChI=1S/C16H13BrClN5O2/c1-25-13-6-5-10(8-12(13)18)20-16(24)14-15(19)23(22-21-14)11-4-2-3-9(17)7-11/h2-8H,19H2,1H3,(H,20,24)