4-methyl-2-[1-[4-methyl-1-(phenylsulfonyl)pentyl]piperidin-3-yl]-1,3-oxazole hydrochloride

Systemtic Name: 4-methyl-2-[1-[4-methyl-1-(phenylsulfonyl)pentyl]piperidin-3-yl]-1,3-oxazole hydrochloride Openeye Name: 2-[1-[1-(benzenesulfonyl)-4-methyl-pentyl]-3-piperidyl]-4-methyl-oxazole hydrochloride CAS Name: 2-[1-[1-(benzenesulfonyl)-4-methylpentyl]-3-piperidinyl]-4-methyloxazole hydrochloride IUPAC Name: 2-[1-[1-(benzenesulfonyl)-4-methylpentyl]piperidin-3-yl]-4-methyl-1,3-oxazole hydrochloride Traditional Name: 2-[1-(1-besyl-4-methyl-pentyl)-3-piperidyl]-4-methyl-oxazole hydrochloride Formula: C21H31ClN2O3S MolecularWeight: 427.00044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=COC(=N1)C2CCCN(C2)C(CCC(C)C)S(=O)(=O)C3=CC=CC=C3.Cl

Isomeric SMILES

CC1=COC(=N1)C2CCCN(C2)C(CCC(C)C)S(=O)(=O)C3=CC=CC=C3.Cl

InChI

InChI=1S/C21H30N2O3S.ClH/c1-16(2)11-12-20(27(24,25)19-9-5-4-6-10-19)23-13-7-8-18(14-23)21-22-17(3)15-26-21;/h4-6,9-10,15-16,18,20H,7-8,11-14H2,1-3H3;1H