actinium; 2-[1-[[3-(4-aminophenyl)-1-methoxy-1-oxidanylidene-propan-2-yl]carbamothioyl]cyclopentyl]ethylazanide

Systemtic Name: actinium; 2-[1-[[3-(4-aminophenyl)-1-methoxy-1-oxidanylidene-propan-2-yl]carbamothioyl]cyclopentyl]ethylazanide Openeye Name: actinium; 2-[1-[[1-[(4-aminophenyl)methyl]-2-methoxy-2-oxo-ethyl]carbamothioyl]cyclopentyl]ethylazanide CAS Name: actinium; 2-[1-[[[3-(4-aminophenyl)-1-methoxy-1-oxopropan-2-yl]amino]-sulfanylidenemethyl]cyclopentyl]ethylazanide IUPAC Name: actinium; 2-[1-[[3-(4-aminophenyl)-1-methoxy-1-oxopropan-2-yl]carbamothioyl]cyclopentyl]ethylazanide Traditional Name: actinium; 2-[1-[[1-(4-aminobenzyl)-2-keto-2-methoxy-ethyl]thiocarbamoyl]cyclopentyl]ethylazanide Formula: C18H26AcN3O2S- MolecularWeight: 575.510687

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=C(C=C1)N)NC(=S)C2(CCCC2)CC[NH-].[Ac]

Isomeric SMILES

COC(=O)C(CC1=CC=C(C=C1)N)NC(=S)C2(CCCC2)CC[NH-].[Ac]

InChI

InChI=1S/C18H26N3O2S.Ac/c1-23-16(22)15(12-13-4-6-14(20)7-5-13)21-17(24)18(10-11-19)8-2-3-9-18;/h4-7,15,19H,2-3,8-12,20H2,1H3,(H,21,24);/q-1;