2-[2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-4H-1,4-benzothiazin-3-one

Systemtic Name: 2-[2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-4H-1,4-benzothiazin-3-one Openeye Name: 2-[2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxo-ethyl]-4H-1,4-benzothiazin-3-one CAS Name: 2-[2-[4-(2,5-dimethylphenyl)-1-piperazinyl]-2-oxoethyl]-4H-1,4-benzothiazin-3-one IUPAC Name: 2-[2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxoethyl]-4H-1,4-benzothiazin-3-one Traditional Name: 2-[2-[4-(2,5-dimethylphenyl)piperazino]-2-keto-ethyl]-4H-1,4-benzothiazin-3-one Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)CC3C(=O)NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)CC3C(=O)NC4=CC=CC=C4S3

InChI

InChI=1S/C22H25N3O2S/c1-15-7-8-16(2)18(13-15)24-9-11-25(12-10-24)21(26)14-20-22(27)23-17-5-3-4-6-19(17)28-20/h3-8,13,20H,9-12,14H2,1-2H3,(H,23,27)