3-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[(6-methoxynaphthalen-2-yl)methyl]propanamide

Systemtic Name: 3-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[(6-methoxynaphthalen-2-yl)methyl]propanamide Openeye Name: 3-[3-(4-ethoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N-[(6-methoxy-2-naphthyl)methyl]propanamide CAS Name: 3-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[(6-methoxy-2-naphthalenyl)methyl]propanamide IUPAC Name: 3-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[(6-methoxynaphthalen-2-yl)methyl]propanamide Traditional Name: N-[(6-methoxy-2-naphthyl)methyl]-3-(3-p-phenetyl-5-thioxo-1H-1,2,4-triazol-4-yl)propionamide Formula: C25H26N4O3S MolecularWeight: 462.56394

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NNC(=S)N2CCC(=O)NCC3=CC4=C(C=C3)C=C(C=C4)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NNC(=S)N2CCC(=O)NCC3=CC4=C(C=C3)C=C(C=C4)OC

InChI

InChI=1S/C25H26N4O3S/c1-3-32-21-9-6-18(7-10-21)24-27-28-25(33)29(24)13-12-23(30)26-16-17-4-5-20-15-22(31-2)11-8-19(20)14-17/h4-11,14-15H,3,12-13,16H2,1-2H3,(H,26,30)(H,28,33)