(2S)-1-(4-methylpiperidin-1-yl)-2-[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]propan-1-one

Systemtic Name: (2S)-1-(4-methylpiperidin-1-yl)-2-[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]propan-1-one Openeye Name: (2S)-1-(4-methyl-1-piperidyl)-2-[[4-phenyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]propan-1-one CAS Name: (2S)-1-(4-methyl-1-piperidinyl)-2-[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-1-propanone IUPAC Name: (2S)-1-(4-methylpiperidin-1-yl)-2-[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]propan-1-one Traditional Name: (2S)-1-(4-methylpiperidino)-2-[[4-phenyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]propan-1-one Formula: C21H24N4OS2 MolecularWeight: 412.57146

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C(C)SC2=NN=C(N2C3=CC=CC=C3)C4=CC=CS4

Isomeric SMILES

CC1CCN(CC1)C(=O)[C@H](C)SC2=NN=C(N2C3=CC=CC=C3)C4=CC=CS4

InChI

InChI=1S/C21H24N4OS2/c1-15-10-12-24(13-11-15)20(26)16(2)28-21-23-22-19(18-9-6-14-27-18)25(21)17-7-4-3-5-8-17/h3-9,14-16H,10-13H2,1-2H3/t16-/m0/s1