N-[[5-(4-bromophenyl)furan-2-yl]methyl]-N-methyl-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanamide

Systemtic Name: N-[[5-(4-bromophenyl)furan-2-yl]methyl]-N-methyl-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanamide Openeye Name: N-[[5-(4-bromophenyl)-2-furyl]methyl]-N-methyl-2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetamide CAS Name: N-[[5-(4-bromophenyl)-2-furanyl]methyl]-N-methyl-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetamide IUPAC Name: N-[[5-(4-bromophenyl)furan-2-yl]methyl]-N-methyl-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetamide Traditional Name: N-[[5-(4-bromophenyl)-2-furyl]methyl]-N-methyl-2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetamide Formula: C19H21BrN4O2S MolecularWeight: 449.36464

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NNC(=S)N1CC(=O)N(C)CC2=CC=C(O2)C3=CC=C(C=C3)Br

Isomeric SMILES

CCCC1=NNC(=S)N1CC(=O)N(C)CC2=CC=C(O2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H21BrN4O2S/c1-3-4-17-21-22-19(27)24(17)12-18(25)23(2)11-15-9-10-16(26-15)13-5-7-14(20)8-6-13/h5-10H,3-4,11-12H2,1-2H3,(H,22,27)