4-[[4-(aminomethyl)-1,2,3-triazol-1-yl]methyl]-N-(3-methylsulfanylphenyl)piperidine-1-carboxamide

Systemtic Name: 4-[[4-(aminomethyl)-1,2,3-triazol-1-yl]methyl]-N-(3-methylsulfanylphenyl)piperidine-1-carboxamide Openeye Name: 4-[[4-(aminomethyl)triazol-1-yl]methyl]-N-(3-methylsulfanylphenyl)piperidine-1-carboxamide CAS Name: 4-[[4-(aminomethyl)-1-triazolyl]methyl]-N-[3-(methylthio)phenyl]-1-piperidinecarboxamide IUPAC Name: 4-[[4-(aminomethyl)triazol-1-yl]methyl]-N-(3-methylsulfanylphenyl)piperidine-1-carboxamide Traditional Name: 4-[[4-(aminomethyl)triazol-1-yl]methyl]-N-[3-(methylthio)phenyl]piperidine-1-carboxamide Formula: C17H24N6OS MolecularWeight: 360.47706

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=O)N2CCC(CC2)CN3C=C(N=N3)CN

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=O)N2CCC(CC2)CN3C=C(N=N3)CN

InChI

InChI=1S/C17H24N6OS/c1-25-16-4-2-3-14(9-16)19-17(24)22-7-5-13(6-8-22)11-23-12-15(10-18)20-21-23/h2-4,9,12-13H,5-8,10-11,18H2,1H3,(H,19,24)