N-[(4-bromophenyl)carbamoyl]-2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-[(4-bromophenyl)carbamoyl]-2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-[(4-bromophenyl)carbamoyl]-2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-[(4-bromoanilino)-oxomethyl]-2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-[(4-bromophenyl)carbamoyl]-2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-[(4-bromophenyl)carbamoyl]-2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)thio]acetamide Formula: C14H14BrN5O2S MolecularWeight: 396.26226

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC(=NN2)SCC(=O)NC(=O)NC3=CC=C(C=C3)Br

Isomeric SMILES

C1CC1C2=NC(=NN2)SCC(=O)NC(=O)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C14H14BrN5O2S/c15-9-3-5-10(6-4-9)16-13(22)17-11(21)7-23-14-18-12(19-20-14)8-1-2-8/h3-6,8H,1-2,7H2,(H,18,19,20)(H2,16,17,21,22)