2-methylpropyl N-[1-[2-[[1-[[2-[[2-(dimethylamino)-2-oxidanylidene-1-phenyl-ethyl]amino]-2-oxidanylidene-ethyl]amino]-5-methyl-1,2-bis(oxidanylidene)hexan-3-yl]carbamoyl]-4-[(2-methylpropan-2-yl)oxy]pyrrolidin-1-yl]-3,3-dimethyl-1-oxidanylidene-butan-2-yl]carbamate

Systemtic Name: 2-methylpropyl N-[1-[2-[[1-[[2-[[2-(dimethylamino)-2-oxidanylidene-1-phenyl-ethyl]amino]-2-oxidanylidene-ethyl]amino]-5-methyl-1,2-bis(oxidanylidene)hexan-3-yl]carbamoyl]-4-[(2-methylpropan-2-yl)oxy]pyrrolidin-1-yl]-3,3-dimethyl-1-oxidanylidene-butan-2-yl]carbamate Openeye Name: isobutyl N-[1-[4-tert-butoxy-2-[[1-[2-[[2-[[2-(dimethylamino)-2-oxo-1-phenyl-ethyl]amino]-2-oxo-ethyl]amino]-2-oxo-acetyl]-3-methyl-butyl]carbamoyl]pyrrolidine-1-carbonyl]-2,2-dimethyl-propyl]carbamate CAS Name: N-[1-[2-[[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-5-methyl-1,2-dioxohexan-3-yl]amino]-oxomethyl]-4-[(2-methylpropan-2-yl)oxy]-1-pyrrolidinyl]-3,3-dimethyl-1-oxobutan-2-yl]carbamic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl N-[1-[2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-5-methyl-1,2-dioxohexan-3-yl]carbamoyl]-4-[(2-methylpropan-2-yl)oxy]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate Traditional Name: N-[1-[4-tert-butoxy-2-[[1-[2-[[2-[[2-(dimethylamino)-2-keto-1-phenyl-ethyl]amino]-2-keto-ethyl]amino]-2-keto-acetyl]-3-methyl-butyl]carbamoyl]pyrrolidine-1-carbonyl]-2,2-dimethyl-propyl]carbamic acid isobutyl ester Formula: C39H62N6O9 MolecularWeight: 758.94438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)C(=O)NCC(=O)NC(C1=CC=CC=C1)C(=O)N(C)C)NC(=O)C2CC(CN2C(=O)C(C(C)(C)C)NC(=O)OCC(C)C)OC(C)(C)C

Isomeric SMILES

CC(C)CC(C(=O)C(=O)NCC(=O)NC(C1=CC=CC=C1)C(=O)N(C)C)NC(=O)C2CC(CN2C(=O)C(C(C)(C)C)NC(=O)OCC(C)C)OC(C)(C)C

InChI

InChI=1S/C39H62N6O9/c1-23(2)18-27(31(47)34(49)40-20-29(46)42-30(35(50)44(11)12)25-16-14-13-15-17-25)41-33(48)28-19-26(54-39(8,9)10)21-45(28)36(51)32(38(5,6)7)43-37(52)53-22-24(3)4/h13-17,23-24,26-28,30,32H,18-22H2,1-12H3,(H,40,49)(H,41,48)(H,42,46)(H,43,52)