methyl 2-[(2R)-1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: methyl 2-[(2R)-1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: methyl 2-[(2R)-1-(3,5-dimethylisoxazol-4-yl)sulfonyl-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[(2R)-1-[(3,5-dimethyl-4-isoxazolyl)sulfonyl]-3-oxo-2-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[(2R)-1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[(2R)-1-(3,5-dimethylisoxazol-4-yl)sulfonyl-3-keto-piperazin-2-yl]acetic acid methyl ester Formula: C12H17N3O6S MolecularWeight: 331.34488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)N2CCNC(=O)C2CC(=O)OC

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N2CCNC(=O)[C@H]2CC(=O)OC

InChI

InChI=1S/C12H17N3O6S/c1-7-11(8(2)21-14-7)22(18,19)15-5-4-13-12(17)9(15)6-10(16)20-3/h9H,4-6H2,1-3H3,(H,13,17)/t9-/m1/s1