1-[2-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]piperidine-3-carboxamide

Systemtic Name: 1-[2-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]piperidine-3-carboxamide Openeye Name: 1-[2-[[4-cyclopropyl-5-(2-thienylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]piperidine-3-carboxamide CAS Name: 1-[2-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]thio]-1-oxoethyl]-3-piperidinecarboxamide IUPAC Name: 1-[2-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]piperidine-3-carboxamide Traditional Name: 1-[2-[[4-cyclopropyl-5-(2-thenyl)-1,2,4-triazol-3-yl]thio]acetyl]nipecotamide Formula: C18H23N5O2S2 MolecularWeight: 405.53752

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CSC2=NN=C(N2C3CC3)CC4=CC=CS4)C(=O)N

Isomeric SMILES

C1CC(CN(C1)C(=O)CSC2=NN=C(N2C3CC3)CC4=CC=CS4)C(=O)N

InChI

InChI=1S/C18H23N5O2S2/c19-17(25)12-3-1-7-22(10-12)16(24)11-27-18-21-20-15(23(18)13-5-6-13)9-14-4-2-8-26-14/h2,4,8,12-13H,1,3,5-7,9-11H2,(H2,19,25)