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

Systemtic Name: N-[(3-bromophenyl)methyl]-N-cyclopropyl-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanamide Openeye Name: N-[(3-bromophenyl)methyl]-N-cyclopropyl-2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetamide CAS Name: N-[(3-bromophenyl)methyl]-N-cyclopropyl-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetamide IUPAC Name: N-[(3-bromophenyl)methyl]-N-cyclopropyl-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetamide Traditional Name: N-(3-bromobenzyl)-N-cyclopropyl-2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetamide Formula: C17H21BrN4OS MolecularWeight: 409.34384

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NNC(=S)N1CC(=O)N(CC2=CC(=CC=C2)Br)C3CC3

Isomeric SMILES

CCCC1=NNC(=S)N1CC(=O)N(CC2=CC(=CC=C2)Br)C3CC3

InChI

InChI=1S/C17H21BrN4OS/c1-2-4-15-19-20-17(24)22(15)11-16(23)21(14-7-8-14)10-12-5-3-6-13(18)9-12/h3,5-6,9,14H,2,4,7-8,10-11H2,1H3,(H,20,24)