4-[[5-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonylfuran-2-yl]methyl]-1,4-benzothiazin-3-one

Systemtic Name: 4-[[5-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonylfuran-2-yl]methyl]-1,4-benzothiazin-3-one Openeye Name: 4-[[5-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-2-furyl]methyl]-1,4-benzothiazin-3-one CAS Name: 4-[[5-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-oxomethyl]-2-furanyl]methyl]-1,4-benzothiazin-3-one IUPAC Name: 4-[[5-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]furan-2-yl]methyl]-1,4-benzothiazin-3-one Traditional Name: 4-[[5-(4-piperonylpiperazine-1-carbonyl)-2-furyl]methyl]-1,4-benzothiazin-3-one Formula: C26H25N3O5S MolecularWeight: 491.5588

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=C(O4)CN5C(=O)CSC6=CC=CC=C65

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=C(O4)CN5C(=O)CSC6=CC=CC=C65

InChI

InChI=1S/C26H25N3O5S/c30-25-16-35-24-4-2-1-3-20(24)29(25)15-19-6-8-22(34-19)26(31)28-11-9-27(10-12-28)14-18-5-7-21-23(13-18)33-17-32-21/h1-8,13H,9-12,14-17H2