(2R)-N-aminocarbonyl-3-methyl-2-[[4-(4-methylphenyl)-5-piperidin-1-yl-1,2,4-triazol-3-yl]sulfanyl]butanamide

Systemtic Name: (2R)-N-aminocarbonyl-3-methyl-2-[[4-(4-methylphenyl)-5-piperidin-1-yl-1,2,4-triazol-3-yl]sulfanyl]butanamide Openeye Name: (2R)-N-carbamoyl-3-methyl-2-[[5-(1-piperidyl)-4-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]butanamide CAS Name: (2R)-N-carbamoyl-3-methyl-2-[[4-(4-methylphenyl)-5-(1-piperidinyl)-1,2,4-triazol-3-yl]thio]butanamide IUPAC Name: (2R)-N-carbamoyl-3-methyl-2-[[4-(4-methylphenyl)-5-piperidin-1-yl-1,2,4-triazol-3-yl]sulfanyl]butanamide Traditional Name: (2R)-N-carbamoyl-3-methyl-2-[[5-piperidino-4-(p-tolyl)-1,2,4-triazol-3-yl]thio]butyramide Formula: C20H28N6O2S MolecularWeight: 416.54032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SC(C(C)C)C(=O)NC(=O)N)N3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2S[C@H](C(C)C)C(=O)NC(=O)N)N3CCCCC3

InChI

InChI=1S/C20H28N6O2S/c1-13(2)16(17(27)22-18(21)28)29-20-24-23-19(25-11-5-4-6-12-25)26(20)15-9-7-14(3)8-10-15/h7-10,13,16H,4-6,11-12H2,1-3H3,(H3,21,22,27,28)/t16-/m1/s1