actinium; 3-[4-(azidomethyl)-2-(2,4-dimethylphenyl)carbonylimino-1,3-thiazol-3-yl]propylazanide

Systemtic Name: actinium; 3-[4-(azidomethyl)-2-(2,4-dimethylphenyl)carbonylimino-1,3-thiazol-3-yl]propylazanide Openeye Name: actinium; 3-[4-(azidomethyl)-2-(2,4-dimethylbenzoyl)imino-thiazol-3-yl]propylazanide CAS Name: actinium; 3-[4-(azidomethyl)-2-[(2,4-dimethylphenyl)-oxomethyl]imino-3-thiazolyl]propylazanide IUPAC Name: actinium; 3-[4-(azidomethyl)-2-(2,4-dimethylbenzoyl)imino-1,3-thiazol-3-yl]propylazanide Traditional Name: actinium; 3-[4-(azidomethyl)-2-(2,4-dimethylbenzoyl)imino-4-thiazolin-3-yl]propylazanide Formula: C16H19AcN6OS- MolecularWeight: 570.454407

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)N=C2N(C(=CS2)CN=[N+]=[N-])CCC[NH-])C.[Ac]

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)N=C2N(C(=CS2)CN=[N+]=[N-])CCC[NH-])C.[Ac]

InChI

InChI=1S/C16H19N6OS.Ac/c1-11-4-5-14(12(2)8-11)15(23)20-16-22(7-3-6-17)13(10-24-16)9-19-21-18;/h4-5,8,10,17H,3,6-7,9H2,1-2H3;/q-1;