6-morpholin-4-ylsulfonyl-4-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl]-1,4-benzoxazin-3-one

Systemtic Name: 6-morpholin-4-ylsulfonyl-4-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl]-1,4-benzoxazin-3-one Openeye Name: 4-[2-(4-benzylpiperazin-1-yl)-2-oxo-ethyl]-6-morpholinosulfonyl-1,4-benzoxazin-3-one CAS Name: 6-(4-morpholinylsulfonyl)-4-[2-oxo-2-[4-(phenylmethyl)-1-piperazinyl]ethyl]-1,4-benzoxazin-3-one IUPAC Name: 4-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-6-morpholin-4-ylsulfonyl-1,4-benzoxazin-3-one Traditional Name: 4-[2-(4-benzylpiperazino)-2-keto-ethyl]-6-morpholinosulfonyl-1,4-benzoxazin-3-one Formula: C25H30N4O6S MolecularWeight: 514.5939

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)CN3C(=O)COC4=C3C=C(C=C4)S(=O)(=O)N5CCOCC5

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)CN3C(=O)COC4=C3C=C(C=C4)S(=O)(=O)N5CCOCC5

InChI

InChI=1S/C25H30N4O6S/c30-24(27-10-8-26(9-11-27)17-20-4-2-1-3-5-20)18-29-22-16-21(6-7-23(22)35-19-25(29)31)36(32,33)28-12-14-34-15-13-28/h1-7,16H,8-15,17-19H2