N-(4-bromanyl-3-methyl-phenyl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-(4-bromo-3-methylphenyl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide IUPAC Name: N-(4-bromo-3-methylphenyl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C16H15BrN4OS2 MolecularWeight: 423.3505

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CCN2C(=NNC2=S)C3=CC=CS3)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CCN2C(=NNC2=S)C3=CC=CS3)Br

InChI

InChI=1S/C16H15BrN4OS2/c1-10-9-11(4-5-12(10)17)18-14(22)6-7-21-15(19-20-16(21)23)13-3-2-8-24-13/h2-5,8-9H,6-7H2,1H3,(H,18,22)(H,20,23)