actinium; [4-[[4-[(5-methyl-1H-pyrazol-3-yl)amino]-7-oxidanylidene-1H-quinazolin-2-yl]sulfanyl]phenyl]azanide

Systemtic Name: actinium; [4-[[4-[(5-methyl-1H-pyrazol-3-yl)amino]-7-oxidanylidene-1H-quinazolin-2-yl]sulfanyl]phenyl]azanide Openeye Name: actinium; [4-[[4-[(5-methyl-1H-pyrazol-3-yl)amino]-7-oxo-1H-quinazolin-2-yl]sulfanyl]phenyl]azanide CAS Name: actinium; [4-[[4-[(5-methyl-1H-pyrazol-3-yl)amino]-7-oxo-1H-quinazolin-2-yl]thio]phenyl]azanide IUPAC Name: actinium; [4-[[4-[(5-methyl-1H-pyrazol-3-yl)amino]-7-oxo-1H-quinazolin-2-yl]sulfanyl]phenyl]azanide Traditional Name: actinium; [4-[[7-keto-4-[(5-methyl-1H-pyrazol-3-yl)amino]-1H-quinazolin-2-yl]thio]phenyl]azanide Formula: C18H15AcN6OS- MolecularWeight: 590.444047

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)NC2=C3C=CC(=O)C=C3NC(=N2)SC4=CC=C(C=C4)[NH-].[Ac]

Isomeric SMILES

CC1=CC(=NN1)NC2=C3C=CC(=O)C=C3NC(=N2)SC4=CC=C(C=C4)[NH-].[Ac]

InChI

InChI=1S/C18H15N6OS.Ac/c1-10-8-16(24-23-10)21-17-14-7-4-12(25)9-15(14)20-18(22-17)26-13-5-2-11(19)3-6-13;/h2-9,19H,1H3,(H3,20,21,22,23,24,25);/q-1;