N,N-diethyl-3-oxidanylidene-4-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl]-1,4-benzoxazine-6-sulfonamide

Systemtic Name: N,N-diethyl-3-oxidanylidene-4-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl]-1,4-benzoxazine-6-sulfonamide Openeye Name: 4-[2-(4-benzylpiperazin-1-yl)-2-oxo-ethyl]-N,N-diethyl-3-oxo-1,4-benzoxazine-6-sulfonamide CAS Name: N,N-diethyl-3-oxo-4-[2-oxo-2-[4-(phenylmethyl)-1-piperazinyl]ethyl]-1,4-benzoxazine-6-sulfonamide IUPAC Name: 4-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-N,N-diethyl-3-oxo-1,4-benzoxazine-6-sulfonamide Traditional Name: 4-[2-(4-benzylpiperazino)-2-keto-ethyl]-N,N-diethyl-3-keto-1,4-benzoxazine-6-sulfonamide Formula: C25H32N4O5S MolecularWeight: 500.61038

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)OCC(=O)N2CC(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)OCC(=O)N2CC(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C25H32N4O5S/c1-3-28(4-2)35(32,33)21-10-11-23-22(16-21)29(25(31)19-34-23)18-24(30)27-14-12-26(13-15-27)17-20-8-6-5-7-9-20/h5-11,16H,3-4,12-15,17-19H2,1-2H3