(2R)-N-(4-piperidin-1-ylsulfonylphenyl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: (2R)-N-(4-piperidin-1-ylsulfonylphenyl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: (2R)-N-[4-(1-piperidylsulfonyl)phenyl]-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: (2R)-N-[4-(1-piperidinylsulfonyl)phenyl]-2-[(5-propyl-1H-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: (2R)-N-(4-piperidin-1-ylsulfonylphenyl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: (2R)-N-(4-piperidinosulfonylphenyl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)thio]propionamide Formula: C19H27N5O3S2 MolecularWeight: 437.57938

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=NN1)SC(C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCCC1=NC(=NN1)S[C@H](C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C19H27N5O3S2/c1-3-7-17-21-19(23-22-17)28-14(2)18(25)20-15-8-10-16(11-9-15)29(26,27)24-12-5-4-6-13-24/h8-11,14H,3-7,12-13H2,1-2H3,(H,20,25)(H,21,22,23)/t14-/m1/s1