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

Systemtic Name: 6-(4-methylpiperidin-1-yl)sulfonyl-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-[(4-methyl-1-piperidyl)sulfonyl]-1,4-benzoxazin-3-one CAS Name: 6-[(4-methyl-1-piperidinyl)sulfonyl]-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-(4-methylpiperidin-1-yl)sulfonyl-1,4-benzoxazin-3-one Traditional Name: 4-[2-(4-benzylpiperazino)-2-keto-ethyl]-6-(4-methylpiperidino)sulfonyl-1,4-benzoxazin-3-one Formula: C27H34N4O5S MolecularWeight: 526.64766

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)OCC(=O)N3CC(=O)N4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)OCC(=O)N3CC(=O)N4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C27H34N4O5S/c1-21-9-11-30(12-10-21)37(34,35)23-7-8-25-24(17-23)31(27(33)20-36-25)19-26(32)29-15-13-28(14-16-29)18-22-5-3-2-4-6-22/h2-8,17,21H,9-16,18-20H2,1H3