(2R)-N-cyclopentyl-2-[[4-(4-methylphenyl)-5-piperidin-1-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: (2R)-N-cyclopentyl-2-[[4-(4-methylphenyl)-5-piperidin-1-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: (2R)-N-cyclopentyl-2-[[5-(1-piperidyl)-4-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: (2R)-N-cyclopentyl-2-[[4-(4-methylphenyl)-5-(1-piperidinyl)-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: (2R)-N-cyclopentyl-2-[[4-(4-methylphenyl)-5-piperidin-1-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: (2R)-N-cyclopentyl-2-[[5-piperidino-4-(p-tolyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C22H31N5OS MolecularWeight: 413.57944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SC(C)C(=O)NC3CCCC3)N4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2S[C@H](C)C(=O)NC3CCCC3)N4CCCCC4

InChI

InChI=1S/C22H31N5OS/c1-16-10-12-19(13-11-16)27-21(26-14-6-3-7-15-26)24-25-22(27)29-17(2)20(28)23-18-8-4-5-9-18/h10-13,17-18H,3-9,14-15H2,1-2H3,(H,23,28)/t17-/m1/s1