N-[[(3S)-1-[2-methyl-6-(2-methylpropyl)pyrimidin-4-yl]carbonylpiperidin-3-yl]methyl]thiophene-2-sulfonamide

Systemtic Name: N-[[(3S)-1-[2-methyl-6-(2-methylpropyl)pyrimidin-4-yl]carbonylpiperidin-3-yl]methyl]thiophene-2-sulfonamide Openeye Name: N-[[(3S)-1-(6-isobutyl-2-methyl-pyrimidine-4-carbonyl)-3-piperidyl]methyl]thiophene-2-sulfonamide CAS Name: N-[[(3S)-1-[[2-methyl-6-(2-methylpropyl)-4-pyrimidinyl]-oxomethyl]-3-piperidinyl]methyl]-2-thiophenesulfonamide IUPAC Name: N-[[(3S)-1-[2-methyl-6-(2-methylpropyl)pyrimidine-4-carbonyl]piperidin-3-yl]methyl]thiophene-2-sulfonamide Traditional Name: N-[[(3S)-1-(6-isobutyl-2-methyl-pyrimidine-4-carbonyl)-3-piperidyl]methyl]thiophene-2-sulfonamide Formula: C20H28N4O3S2 MolecularWeight: 436.59132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)CC(C)C)C(=O)N2CCCC(C2)CNS(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC1=NC(=CC(=N1)CC(C)C)C(=O)N2CCC[C@@H](C2)CNS(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C20H28N4O3S2/c1-14(2)10-17-11-18(23-15(3)22-17)20(25)24-8-4-6-16(13-24)12-21-29(26,27)19-7-5-9-28-19/h5,7,9,11,14,16,21H,4,6,8,10,12-13H2,1-3H3/t16-/m1/s1