(2R)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-piperidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: (2R)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-piperidin-1-ylsulfonylphenyl)propanamide Openeye Name: (2R)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-[4-(1-piperidylsulfonyl)phenyl]propanamide CAS Name: (2R)-2-[(4-methyl-1,2,4-triazol-3-yl)thio]-N-[4-(1-piperidinylsulfonyl)phenyl]propanamide IUPAC Name: (2R)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-piperidin-1-ylsulfonylphenyl)propanamide Traditional Name: (2R)-2-[(4-methyl-1,2,4-triazol-3-yl)thio]-N-(4-piperidinosulfonylphenyl)propionamide Formula: C17H23N5O3S2 MolecularWeight: 409.52622

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2)SC3=NN=CN3C

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2)SC3=NN=CN3C

InChI

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