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

Systemtic Name: N-(3,4-dipropoxyphenyl)-3-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide Openeye Name: N-(3,4-dipropoxyphenyl)-3-[3-(4-ethoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-(3,4-dipropoxyphenyl)-3-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide IUPAC Name: N-(3,4-dipropoxyphenyl)-3-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide Traditional Name: N-(3,4-dipropoxyphenyl)-3-(3-p-phenetyl-5-thioxo-1H-1,2,4-triazol-4-yl)propionamide Formula: C25H32N4O4S MolecularWeight: 484.61098

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)NC(=O)CCN2C(=NNC2=S)C3=CC=C(C=C3)OCC)OCCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)NC(=O)CCN2C(=NNC2=S)C3=CC=C(C=C3)OCC)OCCC

InChI

InChI=1S/C25H32N4O4S/c1-4-15-32-21-12-9-19(17-22(21)33-16-5-2)26-23(30)13-14-29-24(27-28-25(29)34)18-7-10-20(11-8-18)31-6-3/h7-12,17H,4-6,13-16H2,1-3H3,(H,26,30)(H,28,34)