N-[4-[(3R)-3-(4-methyl-5-methylsulfanyl-1,2,4-triazol-3-yl)piperidin-1-yl]sulfonylphenyl]ethanamide

Systemtic Name: N-[4-[(3R)-3-(4-methyl-5-methylsulfanyl-1,2,4-triazol-3-yl)piperidin-1-yl]sulfonylphenyl]ethanamide Openeye Name: N-[4-[[(3R)-3-(4-methyl-5-methylsulfanyl-1,2,4-triazol-3-yl)-1-piperidyl]sulfonyl]phenyl]acetamide CAS Name: N-[4-[[(3R)-3-[4-methyl-5-(methylthio)-1,2,4-triazol-3-yl]-1-piperidinyl]sulfonyl]phenyl]acetamide IUPAC Name: N-[4-[(3R)-3-(4-methyl-5-methylsulfanyl-1,2,4-triazol-3-yl)piperidin-1-yl]sulfonylphenyl]acetamide Traditional Name: N-[4-[(3R)-3-[4-methyl-5-(methylthio)-1,2,4-triazol-3-yl]piperidino]sulfonylphenyl]acetamide Formula: C17H23N5O3S2 MolecularWeight: 409.52622

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C3=NN=C(N3C)SC

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H](C2)C3=NN=C(N3C)SC

InChI

InChI=1S/C17H23N5O3S2/c1-12(23)18-14-6-8-15(9-7-14)27(24,25)22-10-4-5-13(11-22)16-19-20-17(26-3)21(16)2/h6-9,13H,4-5,10-11H2,1-3H3,(H,18,23)/t13-/m1/s1