cyclopentyl N-[2,3-bis[[2-methoxy-4-(phenylsulfonylcarbamoyl)phenyl]methyl]-1-methyl-indol-5-yl]carbamate

Systemtic Name: cyclopentyl N-[2,3-bis[[2-methoxy-4-(phenylsulfonylcarbamoyl)phenyl]methyl]-1-methyl-indol-5-yl]carbamate Openeye Name: cyclopentyl N-[2,3-bis[[4-(benzenesulfonylcarbamoyl)-2-methoxy-phenyl]methyl]-1-methyl-indol-5-yl]carbamate CAS Name: N-[2,3-bis[[4-[benzenesulfonamido(oxo)methyl]-2-methoxyphenyl]methyl]-1-methyl-5-indolyl]carbamic acid cyclopentyl ester IUPAC Name: cyclopentyl N-[2,3-bis[[4-(benzenesulfonylcarbamoyl)-2-methoxyphenyl]methyl]-1-methylindol-5-yl]carbamate Traditional Name: N-[2,3-bis[4-(besylcarbamoyl)-2-methoxy-benzyl]-1-methyl-indol-5-yl]carbamic acid cyclopentyl ester Formula: C45H44N4O10S2 MolecularWeight: 864.98166

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)NC(=O)OC3CCCC3)C(=C1CC4=C(C=C(C=C4)C(=O)NS(=O)(=O)C5=CC=CC=C5)OC)CC6=C(C=C(C=C6)C(=O)NS(=O)(=O)C7=CC=CC=C7)OC

Isomeric SMILES

CN1C2=C(C=C(C=C2)NC(=O)OC3CCCC3)C(=C1CC4=C(C=C(C=C4)C(=O)NS(=O)(=O)C5=CC=CC=C5)OC)CC6=C(C=C(C=C6)C(=O)NS(=O)(=O)C7=CC=CC=C7)OC

InChI

InChI=1S/C45H44N4O10S2/c1-49-39-23-22-33(46-45(52)59-34-12-10-11-13-34)28-38(39)37(24-29-18-20-31(26-41(29)57-2)43(50)47-60(53,54)35-14-6-4-7-15-35)40(49)25-30-19-21-32(27-42(30)58-3)44(51)48-61(55,56)36-16-8-5-9-17-36/h4-9,14-23,26-28,34H,10-13,24-25H2,1-3H3,(H,46,52)(H,47,50)(H,48,51)