7-[3-ethoxy-4-(2-ethoxyethoxy)phenyl]-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-[3-ethoxy-4-(2-ethoxyethoxy)phenyl]-N-[4-[[methyl(oxan-4-yl)amino]methyl]phenyl]-1,1-bis(oxidanylidene)-2,3-dihydro-1$l^{6}-benzothiepine-4-carboxamide Openeye Name: 7-[3-ethoxy-4-(2-ethoxyethoxy)phenyl]-N-[4-[[methyl(tetrahydropyran-4-yl)amino]methyl]phenyl]-1,1-dioxo-2,3-dihydro-1$l^{6}-benzothiepine-4-carboxamide CAS Name: 7-[3-ethoxy-4-(2-ethoxyethoxy)phenyl]-N-[4-[[methyl(4-oxanyl)amino]methyl]phenyl]-1,1-dioxo-2,3-dihydro-1$l^{6}-benzothiepin-4-carboxamide IUPAC Name: 7-[3-ethoxy-4-(2-ethoxyethoxy)phenyl]-N-[4-[[methyl(oxan-4-yl)amino]methyl]phenyl]-1,1-dioxo-2,3-dihydro-1$l^{6}-benzothiepine-4-carboxamide Traditional Name: 7-[3-ethoxy-4-(2-ethoxyethoxy)phenyl]-1,1-diketo-N-[4-[[methyl(tetrahydropyran-4-yl)amino]methyl]phenyl]-2,3-dihydro-1$l^{6}-benzothiepin-4-carboxamide Formula: C36H44N2O7S MolecularWeight: 648.80876

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCOC1=C(C=C(C=C1)C2=CC3=C(C=C2)S(=O)(=O)CCC(=C3)C(=O)NC4=CC=C(C=C4)CN(C)C5CCOCC5)OCC

Isomeric SMILES

CCOCCOC1=C(C=C(C=C1)C2=CC3=C(C=C2)S(=O)(=O)CCC(=C3)C(=O)NC4=CC=C(C=C4)CN(C)C5CCOCC5)OCC

InChI

InChI=1S/C36H44N2O7S/c1-4-42-19-20-45-33-12-8-28(24-34(33)44-5-2)27-9-13-35-30(22-27)23-29(16-21-46(35,40)41)36(39)37-31-10-6-26(7-11-31)25-38(3)32-14-17-43-18-15-32/h6-13,22-24,32H,4-5,14-21,25H2,1-3H3,(H,37,39)