3-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[(3-methylthiophen-2-yl)methyl]propanamide

Systemtic Name: 3-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[(3-methylthiophen-2-yl)methyl]propanamide Openeye Name: 3-[3-(4-ethoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N-[(3-methyl-2-thienyl)methyl]propanamide CAS Name: 3-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[(3-methyl-2-thiophenyl)methyl]propanamide IUPAC Name: 3-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[(3-methylthiophen-2-yl)methyl]propanamide Traditional Name: N-[(3-methyl-2-thienyl)methyl]-3-(3-p-phenetyl-5-thioxo-1H-1,2,4-triazol-4-yl)propionamide Formula: C19H22N4O2S2 MolecularWeight: 402.53358

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NNC(=S)N2CCC(=O)NCC3=C(C=CS3)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NNC(=S)N2CCC(=O)NCC3=C(C=CS3)C

InChI

InChI=1S/C19H22N4O2S2/c1-3-25-15-6-4-14(5-7-15)18-21-22-19(26)23(18)10-8-17(24)20-12-16-13(2)9-11-27-16/h4-7,9,11H,3,8,10,12H2,1-2H3,(H,20,24)(H,22,26)