3-[4-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-ylcarbonyl)-2-methoxy-phenyl]-1-(4-methoxyphenyl)sulfonyl-1-[2-[(7-methyl-1,2,3,4-tetrahydroacridin-9-yl)amino]ethyl]urea

Systemtic Name: 3-[4-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-ylcarbonyl)-2-methoxy-phenyl]-1-(4-methoxyphenyl)sulfonyl-1-[2-[(7-methyl-1,2,3,4-tetrahydroacridin-9-yl)amino]ethyl]urea Openeye Name: 3-[4-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline-1-carbonyl)-2-methoxy-phenyl]-1-(4-methoxyphenyl)sulfonyl-1-[2-[(7-methyl-1,2,3,4-tetrahydroacridin-9-yl)amino]ethyl]urea CAS Name: 3-[4-[3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl(oxo)methyl]-2-methoxyphenyl]-1-(4-methoxyphenyl)sulfonyl-1-[2-[(7-methyl-1,2,3,4-tetrahydroacridin-9-yl)amino]ethyl]urea IUPAC Name: 3-[4-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline-1-carbonyl)-2-methoxyphenyl]-1-(4-methoxyphenyl)sulfonyl-1-[2-[(7-methyl-1,2,3,4-tetrahydroacridin-9-yl)amino]ethyl]urea Traditional Name: 3-[4-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline-1-carbonyl)-2-methoxy-phenyl]-1-(4-methoxyphenyl)sulfonyl-1-[2-[(7-methyl-1,2,3,4-tetrahydroacridin-9-yl)amino]ethyl]urea Formula: C41H49N5O6S MolecularWeight: 739.92266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C3CCCCC3=C2NCCN(C(=O)NC4=C(C=C(C=C4)C(=O)N5CCCC6C5CCCC6)OC)S(=O)(=O)C7=CC=C(C=C7)OC

Isomeric SMILES

CC1=CC2=C(C=C1)N=C3CCCCC3=C2NCCN(C(=O)NC4=C(C=C(C=C4)C(=O)N5CCCC6C5CCCC6)OC)S(=O)(=O)C7=CC=C(C=C7)OC

InChI

InChI=1S/C41H49N5O6S/c1-27-14-20-35-33(25-27)39(32-11-5-6-12-34(32)43-35)42-22-24-46(53(49,50)31-18-16-30(51-2)17-19-31)41(48)44-36-21-15-29(26-38(36)52-3)40(47)45-23-8-10-28-9-4-7-13-37(28)45/h14-21,25-26,28,37H,4-13,22-24H2,1-3H3,(H,42,43)(H,44,48)