1-[3-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanoyl]piperidine-4-carboxamide

Systemtic Name: 1-[3-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanoyl]piperidine-4-carboxamide Openeye Name: 1-[3-[3-(4-ethoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanoyl]piperidine-4-carboxamide CAS Name: 1-[3-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-1-oxopropyl]-4-piperidinecarboxamide IUPAC Name: 1-[3-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanoyl]piperidine-4-carboxamide Traditional Name: 1-[3-(3-p-phenetyl-5-thioxo-1H-1,2,4-triazol-4-yl)propanoyl]isonipecotamide Formula: C19H25N5O3S MolecularWeight: 403.4985

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NNC(=S)N2CCC(=O)N3CCC(CC3)C(=O)N

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NNC(=S)N2CCC(=O)N3CCC(CC3)C(=O)N

InChI

InChI=1S/C19H25N5O3S/c1-2-27-15-5-3-14(4-6-15)18-21-22-19(28)24(18)12-9-16(25)23-10-7-13(8-11-23)17(20)26/h3-6,13H,2,7-12H2,1H3,(H2,20,26)(H,22,28)