(5-methyl-2-oxidanylidene-1,3-dioxol-4-yl)methyl N-[N-[2-[5-[1-(diethylamino)-2-methyl-1-oxidanylidene-propan-2-yl]-2-(3,5-dimethylphenyl)-1H-indol-3-yl]ethyl]-C-(3-pyridin-4-ylpyrrolidin-1-yl)carbonimidoyl]carbamate

Systemtic Name: (5-methyl-2-oxidanylidene-1,3-dioxol-4-yl)methyl N-[N-[2-[5-[1-(diethylamino)-2-methyl-1-oxidanylidene-propan-2-yl]-2-(3,5-dimethylphenyl)-1H-indol-3-yl]ethyl]-C-(3-pyridin-4-ylpyrrolidin-1-yl)carbonimidoyl]carbamate Openeye Name: (5-methyl-2-oxo-1,3-dioxol-4-yl)methyl N-[N-[2-[5-[2-(diethylamino)-1,1-dimethyl-2-oxo-ethyl]-2-(3,5-dimethylphenyl)-1H-indol-3-yl]ethyl]-C-[3-(4-pyridyl)pyrrolidin-1-yl]carbonimidoyl]carbamate CAS Name: N-[2-[5-[1-(diethylamino)-2-methyl-1-oxopropan-2-yl]-2-(3,5-dimethylphenyl)-1H-indol-3-yl]ethylimino-(3-pyridin-4-yl-1-pyrrolidinyl)methyl]carbamic acid (5-methyl-2-oxo-1,3-dioxol-4-yl)methyl ester IUPAC Name: (5-methyl-2-oxo-1,3-dioxol-4-yl)methyl N-[N-[2-[5-[1-(diethylamino)-2-methyl-1-oxopropan-2-yl]-2-(3,5-dimethylphenyl)-1H-indol-3-yl]ethyl]-C-(3-pyridin-4-ylpyrrolidin-1-yl)carbonimidoyl]carbamate Traditional Name: N-[N-[2-[5-[2-(diethylamino)-2-keto-1,1-dimethyl-ethyl]-2-(3,5-dimethylphenyl)-1H-indol-3-yl]ethyl]-C-[3-(4-pyridyl)pyrrolidino]carbonimidoyl]carbamic acid (2-keto-5-methyl-1,3-dioxol-4-yl)methyl ester Formula: C42H50N6O6 MolecularWeight: 734.883

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C(C)(C)C1=CC2=C(C=C1)NC(=C2CCN=C(NC(=O)OCC3=C(OC(=O)O3)C)N4CCC(C4)C5=CC=NC=C5)C6=CC(=CC(=C6)C)C

Isomeric SMILES

CCN(CC)C(=O)C(C)(C)C1=CC2=C(C=C1)NC(=C2CCN=C(NC(=O)OCC3=C(OC(=O)O3)C)N4CCC(C4)C5=CC=NC=C5)C6=CC(=CC(=C6)C)C

InChI

InChI=1S/C42H50N6O6/c1-8-47(9-2)38(49)42(6,7)32-10-11-35-34(23-32)33(37(45-35)31-21-26(3)20-27(4)22-31)14-18-44-39(46-40(50)52-25-36-28(5)53-41(51)54-36)48-19-15-30(24-48)29-12-16-43-17-13-29/h10-13,16-17,20-23,30,45H,8-9,14-15,18-19,24-25H2,1-7H3,(H,44,46,50)