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

Systemtic Name: N-(3,5-dimethoxyphenyl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Openeye Name: N-(3,5-dimethoxyphenyl)-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-(3,5-dimethoxyphenyl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide IUPAC Name: N-(3,5-dimethoxyphenyl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Traditional Name: N-(3,5-dimethoxyphenyl)-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C17H18N4O3S2 MolecularWeight: 390.47982

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=O)CCN2C(=NNC2=S)C3=CC=CS3)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=O)CCN2C(=NNC2=S)C3=CC=CS3)OC

InChI

InChI=1S/C17H18N4O3S2/c1-23-12-8-11(9-13(10-12)24-2)18-15(22)5-6-21-16(19-20-17(21)25)14-4-3-7-26-14/h3-4,7-10H,5-6H2,1-2H3,(H,18,22)(H,20,25)