5-(4-bromophenyl)-N-(3-ethylsulfanyl-5-methyl-1,2,4-triazol-4-yl)furan-2-carboxamide

Systemtic Name: 5-(4-bromophenyl)-N-(3-ethylsulfanyl-5-methyl-1,2,4-triazol-4-yl)furan-2-carboxamide Openeye Name: 5-(4-bromophenyl)-N-(3-ethylsulfanyl-5-methyl-1,2,4-triazol-4-yl)furan-2-carboxamide CAS Name: 5-(4-bromophenyl)-N-[3-(ethylthio)-5-methyl-1,2,4-triazol-4-yl]-2-furancarboxamide IUPAC Name: 5-(4-bromophenyl)-N-(3-ethylsulfanyl-5-methyl-1,2,4-triazol-4-yl)furan-2-carboxamide Traditional Name: 5-(4-bromophenyl)-N-[3-(ethylthio)-5-methyl-1,2,4-triazol-4-yl]-2-furamide Formula: C16H15BrN4O2S MolecularWeight: 407.2849

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(N1NC(=O)C2=CC=C(O2)C3=CC=C(C=C3)Br)C

Isomeric SMILES

CCSC1=NN=C(N1NC(=O)C2=CC=C(O2)C3=CC=C(C=C3)Br)C

InChI

InChI=1S/C16H15BrN4O2S/c1-3-24-16-19-18-10(2)21(16)20-15(22)14-9-8-13(23-14)11-4-6-12(17)7-5-11/h4-9H,3H2,1-2H3,(H,20,22)