1-[2-(8-iodanyl-2-methyl-4-oxidanylidene-quinazolin-3-yl)ethanoylamino]thiourea

Systemtic Name: 1-[2-(8-iodanyl-2-methyl-4-oxidanylidene-quinazolin-3-yl)ethanoylamino]thiourea Openeye Name: [[2-(8-iodo-2-methyl-4-oxo-quinazolin-3-yl)acetyl]amino]thiourea CAS Name: [[2-(8-iodo-2-methyl-4-oxo-3-quinazolinyl)-1-oxoethyl]amino]thiourea IUPAC Name: [[2-(8-iodo-2-methyl-4-oxoquinazolin-3-yl)acetyl]amino]thiourea Traditional Name: [[2-(8-iodo-4-keto-2-methyl-quinazolin-3-yl)acetyl]amino]thiourea Formula: C12H12IN5O2S MolecularWeight: 417.22545

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2I)C(=O)N1CC(=O)NNC(=S)N

Isomeric SMILES

CC1=NC2=C(C=CC=C2I)C(=O)N1CC(=O)NNC(=S)N

InChI

InChI=1S/C12H12IN5O2S/c1-6-15-10-7(3-2-4-8(10)13)11(20)18(6)5-9(19)16-17-12(14)21/h2-4H,5H2,1H3,(H,16,19)(H3,14,17,21)