ethyl 2-[6-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]sulfonyl-2-oxidanylidene-1,3-benzoxazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[6-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]sulfonyl-2-oxidanylidene-1,3-benzoxazol-3-yl]ethanoate Openeye Name: ethyl 2-[6-[3-methyl-4-(m-tolyl)piperazin-1-yl]sulfonyl-2-oxo-1,3-benzoxazol-3-yl]acetate CAS Name: 2-[6-[[3-methyl-4-(3-methylphenyl)-1-piperazinyl]sulfonyl]-2-oxo-1,3-benzoxazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[6-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]sulfonyl-2-oxo-1,3-benzoxazol-3-yl]acetate Traditional Name: 2-[2-keto-6-[3-methyl-4-(m-tolyl)piperazino]sulfonyl-1,3-benzoxazol-3-yl]acetic acid ethyl ester Formula: C23H27N3O6S MolecularWeight: 473.54198

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCN(C(C3)C)C4=CC=CC(=C4)C)OC1=O

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCN(C(C3)C)C4=CC=CC(=C4)C)OC1=O

InChI

InChI=1S/C23H27N3O6S/c1-4-31-22(27)15-26-20-9-8-19(13-21(20)32-23(26)28)33(29,30)24-10-11-25(17(3)14-24)18-7-5-6-16(2)12-18/h5-9,12-13,17H,4,10-11,14-15H2,1-3H3