actinium; 1-[(E)-[3-methyl-4-(1-methyl-3-oxidanylidene-1-azacyclotridec-2-yl)-4-oxidanyl-butylidene]amino]urea

Systemtic Name: actinium; 1-[(E)-[3-methyl-4-(1-methyl-3-oxidanylidene-1-azacyclotridec-2-yl)-4-oxidanyl-butylidene]amino]urea Openeye Name: actinium; [(E)-[4-hydroxy-3-methyl-4-(1-methyl-3-oxo-azacyclotridec-2-yl)butylidene]amino]urea CAS Name: actinium; [(E)-[4-hydroxy-3-methyl-4-(1-methyl-3-oxo-azacyclotridec-2-yl)butylidene]amino]urea IUPAC Name: actinium; [(E)-[4-hydroxy-3-methyl-4-(1-methyl-3-oxo-azacyclotridec-2-yl)butylidene]amino]urea Traditional Name: actinium; [(E)-[4-hydroxy-4-(3-keto-1-methyl-azacyclotridec-2-yl)-3-methyl-butylidene]amino]urea Formula: C19H36AcN4O3 MolecularWeight: 595.541887

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC=NNC(=O)N)C(C1C(=O)CCCCCCCCCCN1C)O.[Ac]

Isomeric SMILES

CC(C/C=N/NC(=O)N)C(C1C(=O)CCCCCCCCCCN1C)O.[Ac]

InChI

InChI=1S/C19H36N4O3.Ac/c1-15(12-13-21-22-19(20)26)18(25)17-16(24)11-9-7-5-3-4-6-8-10-14-23(17)2;/h13,15,17-18,25H,3-12,14H2,1-2H3,(H3,20,22,26);/b21-13+;