2-methylpropyl N-[1-[2-[[1-[[2-[[2-(dimethylamino)-2-oxidanylidene-1-phenyl-ethyl]amino]-2-oxidanylidene-ethyl]amino]-6-methyl-1,2-bis(oxidanylidene)heptan-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]-6-methyl-1,2-bis(oxidanylidene)heptan-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]-4-methyl-pentyl]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]-6-methyl-1,2-dioxoheptan-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]-6-methyl-1,2-dioxoheptan-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]-4-methyl-pentyl]carbamoyl]pyrrolidine-1-carbonyl]-2,2-dimethyl-propyl]carbamic acid isobutyl ester Formula: C40H64N6O9 MolecularWeight: 772.97096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(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)CCC(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/C40H64N6O9/c1-24(2)18-19-28(32(48)35(50)41-21-30(47)43-31(36(51)45(11)12)26-16-14-13-15-17-26)42-34(49)29-20-27(55-40(8,9)10)22-46(29)37(52)33(39(5,6)7)44-38(53)54-23-25(3)4/h13-17,24-25,27-29,31,33H,18-23H2,1-12H3,(H,41,50)(H,42,49)(H,43,47)(H,44,53)