1-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperazin-1-yl]-4-(4-methylphenoxy)butan-1-one

Systemtic Name: 1-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperazin-1-yl]-4-(4-methylphenoxy)butan-1-one Openeye Name: 1-[4-(3,5-dimethylisoxazol-4-yl)sulfonylpiperazin-1-yl]-4-(4-methylphenoxy)butan-1-one CAS Name: 1-[4-[(3,5-dimethyl-4-isoxazolyl)sulfonyl]-1-piperazinyl]-4-(4-methylphenoxy)-1-butanone IUPAC Name: 1-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperazin-1-yl]-4-(4-methylphenoxy)butan-1-one Traditional Name: 1-[4-(3,5-dimethylisoxazol-4-yl)sulfonylpiperazino]-4-(4-methylphenoxy)butan-1-one Formula: C20H27N3O5S MolecularWeight: 421.51048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCCC(=O)N2CCN(CC2)S(=O)(=O)C3=C(ON=C3C)C

Isomeric SMILES

CC1=CC=C(C=C1)OCCCC(=O)N2CCN(CC2)S(=O)(=O)C3=C(ON=C3C)C

InChI

InChI=1S/C20H27N3O5S/c1-15-6-8-18(9-7-15)27-14-4-5-19(24)22-10-12-23(13-11-22)29(25,26)20-16(2)21-28-17(20)3/h6-9H,4-5,10-14H2,1-3H3