2-[4-oxidanylidene-3-[2-oxidanylidene-2-[4-(phenylsulfonyl)piperazin-1-yl]ethyl]-1,3-benzothiazin-2-ylidene]ethanenitrile

Systemtic Name: 2-[4-oxidanylidene-3-[2-oxidanylidene-2-[4-(phenylsulfonyl)piperazin-1-yl]ethyl]-1,3-benzothiazin-2-ylidene]ethanenitrile Openeye Name: 2-[3-[2-[4-(benzenesulfonyl)piperazin-1-yl]-2-oxo-ethyl]-4-oxo-1,3-benzothiazin-2-ylidene]acetonitrile CAS Name: 2-[3-[2-[4-(benzenesulfonyl)-1-piperazinyl]-2-oxoethyl]-4-oxo-1,3-benzothiazin-2-ylidene]acetonitrile IUPAC Name: 2-[3-[2-[4-(benzenesulfonyl)piperazin-1-yl]-2-oxoethyl]-4-oxo-1,3-benzothiazin-2-ylidene]acetonitrile Traditional Name: 2-[3-[2-(4-besylpiperazino)-2-keto-ethyl]-4-keto-1,3-benzothiazin-2-ylidene]acetonitrile Formula: C22H20N4O4S2 MolecularWeight: 468.5486

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CN2C(=CC#N)SC3=CC=CC=C3C2=O)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)CN2C(=CC#N)SC3=CC=CC=C3C2=O)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H20N4O4S2/c23-11-10-21-26(22(28)18-8-4-5-9-19(18)31-21)16-20(27)24-12-14-25(15-13-24)32(29,30)17-6-2-1-3-7-17/h1-10H,12-16H2