2-[[4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(1-methylsulfonylpiperidin-4-yl)ethanamide

Systemtic Name: 2-[[4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(1-methylsulfonylpiperidin-4-yl)ethanamide Openeye Name: N-(1-methylsulfonyl-4-piperidyl)-2-[[4-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: 2-[[4-(4-methylphenyl)-1,2,4-triazol-3-yl]thio]-N-(1-methylsulfonyl-4-piperidinyl)acetamide IUPAC Name: 2-[[4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(1-methylsulfonylpiperidin-4-yl)acetamide Traditional Name: N-(1-mesyl-4-piperidyl)-2-[[4-(p-tolyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C17H23N5O3S2 MolecularWeight: 409.52622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C=NN=C2SCC(=O)NC3CCN(CC3)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C=NN=C2SCC(=O)NC3CCN(CC3)S(=O)(=O)C

InChI

InChI=1S/C17H23N5O3S2/c1-13-3-5-15(6-4-13)22-12-18-20-17(22)26-11-16(23)19-14-7-9-21(10-8-14)27(2,24)25/h3-6,12,14H,7-11H2,1-2H3,(H,19,23)