(2S)-2-azanyl-1-[4-(4-cyclohexyl-1,2,3-triazol-1-yl)piperidin-1-yl]-4-methylsulfanyl-butan-1-one

Systemtic Name: (2S)-2-azanyl-1-[4-(4-cyclohexyl-1,2,3-triazol-1-yl)piperidin-1-yl]-4-methylsulfanyl-butan-1-one Openeye Name: (2S)-2-amino-1-[4-(4-cyclohexyltriazol-1-yl)-1-piperidyl]-4-methylsulfanyl-butan-1-one CAS Name: (2S)-2-amino-1-[4-(4-cyclohexyl-1-triazolyl)-1-piperidinyl]-4-(methylthio)-1-butanone IUPAC Name: (2S)-2-amino-1-[4-(4-cyclohexyltriazol-1-yl)piperidin-1-yl]-4-methylsulfanylbutan-1-one Traditional Name: (2S)-2-amino-1-[4-(4-cyclohexyltriazol-1-yl)piperidino]-4-(methylthio)butan-1-one Formula: C18H31N5OS MolecularWeight: 365.53664

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)N1CCC(CC1)N2C=C(N=N2)C3CCCCC3)N

Isomeric SMILES

CSCC[C@@H](C(=O)N1CCC(CC1)N2C=C(N=N2)C3CCCCC3)N

InChI

InChI=1S/C18H31N5OS/c1-25-12-9-16(19)18(24)22-10-7-15(8-11-22)23-13-17(20-21-23)14-5-3-2-4-6-14/h13-16H,2-12,19H2,1H3/t16-/m0/s1