4-[[3-[4-(4-methoxyphenyl)piperazin-1-yl]carbonylphenyl]methyl]-1,4-benzothiazin-3-one

Systemtic Name: 4-[[3-[4-(4-methoxyphenyl)piperazin-1-yl]carbonylphenyl]methyl]-1,4-benzothiazin-3-one Openeye Name: 4-[[3-[4-(4-methoxyphenyl)piperazine-1-carbonyl]phenyl]methyl]-1,4-benzothiazin-3-one CAS Name: 4-[[3-[[4-(4-methoxyphenyl)-1-piperazinyl]-oxomethyl]phenyl]methyl]-1,4-benzothiazin-3-one IUPAC Name: 4-[[3-[4-(4-methoxyphenyl)piperazine-1-carbonyl]phenyl]methyl]-1,4-benzothiazin-3-one Traditional Name: 4-[3-[4-(4-methoxyphenyl)piperazine-1-carbonyl]benzyl]-1,4-benzothiazin-3-one Formula: C27H27N3O3S MolecularWeight: 473.58658

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CC(=CC=C3)CN4C(=O)CSC5=CC=CC=C54

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CC(=CC=C3)CN4C(=O)CSC5=CC=CC=C54

InChI

InChI=1S/C27H27N3O3S/c1-33-23-11-9-22(10-12-23)28-13-15-29(16-14-28)27(32)21-6-4-5-20(17-21)18-30-24-7-2-3-8-25(24)34-19-26(30)31/h2-12,17H,13-16,18-19H2,1H3