actinium; [1-[[1-[5-[[1,2-bis(oxidanylidene)-1-(prop-2-enylamino)hexan-3-yl]carbamoyl]-3-(2-ethoxy-2-oxidanylidene-ethyl)-2-oxidanylidene-imidazolidin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]amino]-5-oxidanyl-1,5-bis(oxidanylidene)pentan-2-yl]azanide

Systemtic Name: actinium; [1-[[1-[5-[[1,2-bis(oxidanylidene)-1-(prop-2-enylamino)hexan-3-yl]carbamoyl]-3-(2-ethoxy-2-oxidanylidene-ethyl)-2-oxidanylidene-imidazolidin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]amino]-5-oxidanyl-1,5-bis(oxidanylidene)pentan-2-yl]azanide Openeye Name: actinium; [1-[[1-[5-[1-[2-(allylamino)-2-oxo-acetyl]butylcarbamoyl]-3-(2-ethoxy-2-oxo-ethyl)-2-oxo-imidazolidine-1-carbonyl]-2-methyl-propyl]carbamoyl]-4-hydroxy-4-oxo-butyl]azanide CAS Name: actinium; [1-[[1-[5-[[[1,2-dioxo-1-(prop-2-enylamino)hexan-3-yl]amino]-oxomethyl]-3-(2-ethoxy-2-oxoethyl)-2-oxo-1-imidazolidinyl]-3-methyl-1-oxobutan-2-yl]amino]-5-hydroxy-1,5-dioxopentan-2-yl]azanide IUPAC Name: actinium; [1-[[1-[5-[[1,2-dioxo-1-(prop-2-enylamino)hexan-3-yl]carbamoyl]-3-(2-ethoxy-2-oxoethyl)-2-oxoimidazolidin-1-yl]-3-methyl-1-oxobutan-2-yl]amino]-5-hydroxy-1,5-dioxopentan-2-yl]azanide Traditional Name: actinium; [1-[[1-[5-[1-[2-(allylamino)-2-keto-acetyl]butylcarbamoyl]-3-(2-ethoxy-2-keto-ethyl)-2-keto-imidazolidine-1-carbonyl]-2-methyl-propyl]carbamoyl]-4-hydroxy-4-keto-butyl]azanide Formula: C27H41AcN6O10- MolecularWeight: 836.676387

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)C(=O)NCC=C)NC(=O)C1CN(C(=O)N1C(=O)C(C(C)C)NC(=O)C(CCC(=O)O)[NH-])CC(=O)OCC.[Ac]

Isomeric SMILES

CCCC(C(=O)C(=O)NCC=C)NC(=O)C1CN(C(=O)N1C(=O)C(C(C)C)NC(=O)C(CCC(=O)O)[NH-])CC(=O)OCC.[Ac]

InChI

InChI=1S/C27H41N6O10.Ac/c1-6-9-17(22(37)25(40)29-12-7-2)30-24(39)18-13-32(14-20(36)43-8-3)27(42)33(18)26(41)21(15(4)5)31-23(38)16(28)10-11-19(34)35;/h7,15-18,21,28H,2,6,8-14H2,1,3-5H3,(H,29,40)(H,30,39)(H,31,38)(H,34,35);/q-1;