3-methyl-6-[3-oxidanylidene-3-(4-phenylpiperazin-1-yl)propyl]sulfonyl-1,3-benzoxazol-2-one

Systemtic Name: 3-methyl-6-[3-oxidanylidene-3-(4-phenylpiperazin-1-yl)propyl]sulfonyl-1,3-benzoxazol-2-one Openeye Name: 3-methyl-6-[3-oxo-3-(4-phenylpiperazin-1-yl)propyl]sulfonyl-1,3-benzoxazol-2-one CAS Name: 3-methyl-6-[3-oxo-3-(4-phenyl-1-piperazinyl)propyl]sulfonyl-1,3-benzoxazol-2-one IUPAC Name: 3-methyl-6-[3-oxo-3-(4-phenylpiperazin-1-yl)propyl]sulfonyl-1,3-benzoxazol-2-one Traditional Name: 6-[3-keto-3-(4-phenylpiperazino)propyl]sulfonyl-3-methyl-1,3-benzoxazol-2-one Formula: C21H23N3O5S MolecularWeight: 429.48942

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)CCC(=O)N3CCN(CC3)C4=CC=CC=C4)OC1=O

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)CCC(=O)N3CCN(CC3)C4=CC=CC=C4)OC1=O

InChI

InChI=1S/C21H23N3O5S/c1-22-18-8-7-17(15-19(18)29-21(22)26)30(27,28)14-9-20(25)24-12-10-23(11-13-24)16-5-3-2-4-6-16/h2-8,15H,9-14H2,1H3