N-[4-(2-azanyl-2-oxidanylidene-ethyl)-1,3-thiazol-2-yl]-1-(3-bromophenyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: N-[4-(2-azanyl-2-oxidanylidene-ethyl)-1,3-thiazol-2-yl]-1-(3-bromophenyl)-1,2,3-triazole-4-carboxamide Openeye Name: N-[4-(2-amino-2-oxo-ethyl)thiazol-2-yl]-1-(3-bromophenyl)triazole-4-carboxamide CAS Name: N-[4-(2-amino-2-oxoethyl)-2-thiazolyl]-1-(3-bromophenyl)-4-triazolecarboxamide IUPAC Name: N-[4-(2-amino-2-oxoethyl)-1,3-thiazol-2-yl]-1-(3-bromophenyl)triazole-4-carboxamide Traditional Name: N-[4-(2-amino-2-keto-ethyl)thiazol-2-yl]-1-(3-bromophenyl)triazole-4-carboxamide Formula: C14H11BrN6O2S MolecularWeight: 407.24514

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)N2C=C(N=N2)C(=O)NC3=NC(=CS3)CC(=O)N

Isomeric SMILES

C1=CC(=CC(=C1)Br)N2C=C(N=N2)C(=O)NC3=NC(=CS3)CC(=O)N

InChI

InChI=1S/C14H11BrN6O2S/c15-8-2-1-3-10(4-8)21-6-11(19-20-21)13(23)18-14-17-9(7-24-14)5-12(16)22/h1-4,6-7H,5H2,(H2,16,22)(H,17,18,23)