7-(1-benzofuran-2-yl)-N-[4-[[methyl(oxan-4-yl)amino]methyl]phenyl]-1,1-bis(oxidanylidene)-2,3-dihydro-1$l^{6}-benzothiepine-4-carboxamide

Systemtic Name: 7-(1-benzofuran-2-yl)-N-[4-[[methyl(oxan-4-yl)amino]methyl]phenyl]-1,1-bis(oxidanylidene)-2,3-dihydro-1$l^{6}-benzothiepine-4-carboxamide Openeye Name: 7-(benzofuran-2-yl)-N-[4-[[methyl(tetrahydropyran-4-yl)amino]methyl]phenyl]-1,1-dioxo-2,3-dihydro-1$l^{6}-benzothiepine-4-carboxamide CAS Name: 7-(2-benzofuranyl)-N-[4-[[methyl(4-oxanyl)amino]methyl]phenyl]-1,1-dioxo-2,3-dihydro-1$l^{6}-benzothiepin-4-carboxamide IUPAC Name: 7-(1-benzofuran-2-yl)-N-[4-[[methyl(oxan-4-yl)amino]methyl]phenyl]-1,1-dioxo-2,3-dihydro-1$l^{6}-benzothiepine-4-carboxamide Traditional Name: 7-(benzofuran-2-yl)-1,1-diketo-N-[4-[[methyl(tetrahydropyran-4-yl)amino]methyl]phenyl]-2,3-dihydro-1$l^{6}-benzothiepin-4-carboxamide Formula: C32H32N2O5S MolecularWeight: 556.67188

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)NC(=O)C2=CC3=C(C=CC(=C3)C4=CC5=CC=CC=C5O4)S(=O)(=O)CC2)C6CCOCC6

Isomeric SMILES

CN(CC1=CC=C(C=C1)NC(=O)C2=CC3=C(C=CC(=C3)C4=CC5=CC=CC=C5O4)S(=O)(=O)CC2)C6CCOCC6

InChI

InChI=1S/C32H32N2O5S/c1-34(28-12-15-38-16-13-28)21-22-6-9-27(10-7-22)33-32(35)25-14-17-40(36,37)31-11-8-24(18-26(31)19-25)30-20-23-4-2-3-5-29(23)39-30/h2-11,18-20,28H,12-17,21H2,1H3,(H,33,35)