1-[[3-(3-methoxyphenyl)-4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]piperidine-4-carboxamide

Systemtic Name: 1-[[3-(3-methoxyphenyl)-4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]piperidine-4-carboxamide Openeye Name: 1-[[3-(3-methoxyphenyl)-4-methyl-5-thioxo-1,2,4-triazol-1-yl]methyl]piperidine-4-carboxamide CAS Name: 1-[[3-(3-methoxyphenyl)-4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]-4-piperidinecarboxamide IUPAC Name: 1-[[3-(3-methoxyphenyl)-4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]piperidine-4-carboxamide Traditional Name: 1-[[3-(3-methoxyphenyl)-4-methyl-5-thioxo-1,2,4-triazol-1-yl]methyl]isonipecotamide Formula: C17H23N5O2S MolecularWeight: 361.46182

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN(C1=S)CN2CCC(CC2)C(=O)N)C3=CC(=CC=C3)OC

Isomeric SMILES

CN1C(=NN(C1=S)CN2CCC(CC2)C(=O)N)C3=CC(=CC=C3)OC

InChI

InChI=1S/C17H23N5O2S/c1-20-16(13-4-3-5-14(10-13)24-2)19-22(17(20)25)11-21-8-6-12(7-9-21)15(18)23/h3-5,10,12H,6-9,11H2,1-2H3,(H2,18,23)