4-[[4-[2-(2,3-dihydro-1,4-benzothiazin-4-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-[2-(2,3-dihydro-1,4-benzothiazin-4-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-[2-(2,3-dihydro-1,4-benzothiazin-4-yl)-2-oxo-ethyl]piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[2-(2,3-dihydro-1,4-benzothiazin-4-yl)-2-oxoethyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-[2-(2,3-dihydro-1,4-benzothiazin-4-yl)-2-oxoethyl]piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-[2-(2,3-dihydro-1,4-benzothiazin-4-yl)-2-keto-ethyl]piperazino]methyl]benzonitrile Formula: C22H24N4OS MolecularWeight: 392.51716

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)C#N)CC(=O)N3CCSC4=CC=CC=C43

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)C#N)CC(=O)N3CCSC4=CC=CC=C43

InChI

InChI=1S/C22H24N4OS/c23-15-18-5-7-19(8-6-18)16-24-9-11-25(12-10-24)17-22(27)26-13-14-28-21-4-2-1-3-20(21)26/h1-8H,9-14,16-17H2