6-[3-[4-(4-chlorophenyl)piperazin-1-yl]-3-oxidanylidene-propyl]sulfonyl-4H-1,4-benzothiazin-3-one

Systemtic Name: 6-[3-[4-(4-chlorophenyl)piperazin-1-yl]-3-oxidanylidene-propyl]sulfonyl-4H-1,4-benzothiazin-3-one Openeye Name: 6-[3-[4-(4-chlorophenyl)piperazin-1-yl]-3-oxo-propyl]sulfonyl-4H-1,4-benzothiazin-3-one CAS Name: 6-[3-[4-(4-chlorophenyl)-1-piperazinyl]-3-oxopropyl]sulfonyl-4H-1,4-benzothiazin-3-one IUPAC Name: 6-[3-[4-(4-chlorophenyl)piperazin-1-yl]-3-oxopropyl]sulfonyl-4H-1,4-benzothiazin-3-one Traditional Name: 6-[3-[4-(4-chlorophenyl)piperazino]-3-keto-propyl]sulfonyl-4H-1,4-benzothiazin-3-one Formula: C21H22ClN3O4S2 MolecularWeight: 480.00008

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)Cl)C(=O)CCS(=O)(=O)C3=CC4=C(C=C3)SCC(=O)N4

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)Cl)C(=O)CCS(=O)(=O)C3=CC4=C(C=C3)SCC(=O)N4

InChI

InChI=1S/C21H22ClN3O4S2/c22-15-1-3-16(4-2-15)24-8-10-25(11-9-24)21(27)7-12-31(28,29)17-5-6-19-18(13-17)23-20(26)14-30-19/h1-6,13H,7-12,14H2,(H,23,26)