N-(4-bromophenyl)-3-[[4-methyl-5-(2-methylfuran-3-yl)-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: N-(4-bromophenyl)-3-[[4-methyl-5-(2-methylfuran-3-yl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: N-(4-bromophenyl)-3-[[4-methyl-5-(2-methyl-3-furyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-(4-bromophenyl)-3-[[4-methyl-5-(2-methyl-3-furanyl)-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-(4-bromophenyl)-3-[[4-methyl-5-(2-methylfuran-3-yl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: N-(4-bromophenyl)-3-[[4-methyl-5-(2-methyl-3-furyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C17H17BrN4O2S MolecularWeight: 421.31148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C2=NN=C(N2C)SCCC(=O)NC3=CC=C(C=C3)Br

Isomeric SMILES

CC1=C(C=CO1)C2=NN=C(N2C)SCCC(=O)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C17H17BrN4O2S/c1-11-14(7-9-24-11)16-20-21-17(22(16)2)25-10-8-15(23)19-13-5-3-12(18)4-6-13/h3-7,9H,8,10H2,1-2H3,(H,19,23)