3-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-methyl-N-[(2-piperidin-1-ylphenyl)methyl]propanamide

Systemtic Name: 3-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-methyl-N-[(2-piperidin-1-ylphenyl)methyl]propanamide Openeye Name: 3-[3-(4-methoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N-methyl-N-[[2-(1-piperidyl)phenyl]methyl]propanamide CAS Name: 3-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-methyl-N-[[2-(1-piperidinyl)phenyl]methyl]propanamide IUPAC Name: 3-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-methyl-N-[(2-piperidin-1-ylphenyl)methyl]propanamide Traditional Name: 3-[3-(4-methoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N-methyl-N-(2-piperidinobenzyl)propionamide Formula: C25H31N5O2S MolecularWeight: 465.61094

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1N2CCCCC2)C(=O)CCN3C(=NNC3=S)C4=CC=C(C=C4)OC

Isomeric SMILES

CN(CC1=CC=CC=C1N2CCCCC2)C(=O)CCN3C(=NNC3=S)C4=CC=C(C=C4)OC

InChI

InChI=1S/C25H31N5O2S/c1-28(18-20-8-4-5-9-22(20)29-15-6-3-7-16-29)23(31)14-17-30-24(26-27-25(30)33)19-10-12-21(32-2)13-11-19/h4-5,8-13H,3,6-7,14-18H2,1-2H3,(H,27,33)