N-(2-ethoxyphenyl)-2-[[4-(4-methylphenyl)-5-piperidin-1-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: N-(2-ethoxyphenyl)-2-[[4-(4-methylphenyl)-5-piperidin-1-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: N-(2-ethoxyphenyl)-2-[[5-(1-piperidyl)-4-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-(2-ethoxyphenyl)-2-[[4-(4-methylphenyl)-5-(1-piperidinyl)-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-(2-ethoxyphenyl)-2-[[4-(4-methylphenyl)-5-piperidin-1-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: N-o-phenetyl-2-[[5-piperidino-4-(p-tolyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C25H31N5O2S MolecularWeight: 465.61094

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)C(C)SC2=NN=C(N2C3=CC=C(C=C3)C)N4CCCCC4

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)C(C)SC2=NN=C(N2C3=CC=C(C=C3)C)N4CCCCC4

InChI

InChI=1S/C25H31N5O2S/c1-4-32-22-11-7-6-10-21(22)26-23(31)19(3)33-25-28-27-24(29-16-8-5-9-17-29)30(25)20-14-12-18(2)13-15-20/h6-7,10-15,19H,4-5,8-9,16-17H2,1-3H3,(H,26,31)