3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]propan-1-one

Systemtic Name: 3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]propan-1-one Openeye Name: 1-(4-benzylsulfonylpiperazin-1-yl)-3-(3,5-dimethylisoxazol-4-yl)propan-1-one CAS Name: 3-(3,5-dimethyl-4-isoxazolyl)-1-[4-(phenylmethyl)sulfonyl-1-piperazinyl]-1-propanone IUPAC Name: 1-(4-benzylsulfonylpiperazin-1-yl)-3-(3,5-dimethyl-1,2-oxazol-4-yl)propan-1-one Traditional Name: 1-(4-benzylsulfonylpiperazino)-3-(3,5-dimethylisoxazol-4-yl)propan-1-one Formula: C19H25N3O4S MolecularWeight: 391.4845

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CCC(=O)N2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NO1)C)CCC(=O)N2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C19H25N3O4S/c1-15-18(16(2)26-20-15)8-9-19(23)21-10-12-22(13-11-21)27(24,25)14-17-6-4-3-5-7-17/h3-7H,8-14H2,1-2H3