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

Systemtic Name: 4-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl]-6-pyrrolidin-1-ylsulfonyl-1,4-benzothiazin-3-one Openeye Name: 4-[2-(4-benzylpiperazin-1-yl)-2-oxo-ethyl]-6-pyrrolidin-1-ylsulfonyl-1,4-benzothiazin-3-one CAS Name: 4-[2-oxo-2-[4-(phenylmethyl)-1-piperazinyl]ethyl]-6-(1-pyrrolidinylsulfonyl)-1,4-benzothiazin-3-one IUPAC Name: 4-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-6-pyrrolidin-1-ylsulfonyl-1,4-benzothiazin-3-one Traditional Name: 4-[2-(4-benzylpiperazino)-2-keto-ethyl]-6-pyrrolidinosulfonyl-1,4-benzothiazin-3-one Formula: C25H30N4O4S2 MolecularWeight: 514.6601

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)SCC(=O)N3CC(=O)N4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)SCC(=O)N3CC(=O)N4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C25H30N4O4S2/c30-24(27-14-12-26(13-15-27)17-20-6-2-1-3-7-20)18-29-22-16-21(8-9-23(22)34-19-25(29)31)35(32,33)28-10-4-5-11-28/h1-3,6-9,16H,4-5,10-15,17-19H2