4-[2-[(1-ethoxycarbonylpiperidin-4-yl)amino]-2-oxidanylidene-ethyl]-5-(4-methoxyphenyl)-1,2,4-triazole-3-thiolate

Systemtic Name: 4-[2-[(1-ethoxycarbonylpiperidin-4-yl)amino]-2-oxidanylidene-ethyl]-5-(4-methoxyphenyl)-1,2,4-triazole-3-thiolate Openeye Name: 4-[2-[(1-ethoxycarbonyl-4-piperidyl)amino]-2-oxo-ethyl]-5-(4-methoxyphenyl)-1,2,4-triazole-3-thiolate CAS Name: 4-[2-[(1-ethoxycarbonyl-4-piperidinyl)amino]-2-oxoethyl]-5-(4-methoxyphenyl)-1,2,4-triazole-3-thiolate IUPAC Name: 4-[2-[(1-ethoxycarbonylpiperidin-4-yl)amino]-2-oxoethyl]-5-(4-methoxyphenyl)-1,2,4-triazole-3-thiolate Traditional Name: 4-[2-[(1-carbethoxy-4-piperidyl)amino]-2-keto-ethyl]-5-(4-methoxyphenyl)-1,2,4-triazole-3-thiolate Formula: C19H24N5O4S- MolecularWeight: 418.48996

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)CN2C(=NN=C2[S-])C3=CC=C(C=C3)OC

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)CN2C(=NN=C2[S-])C3=CC=C(C=C3)OC

InChI

InChI=1S/C19H25N5O4S/c1-3-28-19(26)23-10-8-14(9-11-23)20-16(25)12-24-17(21-22-18(24)29)13-4-6-15(27-2)7-5-13/h4-7,14H,3,8-12H2,1-2H3,(H,20,25)(H,22,29)/p-1