6-iodanyl-3-(3-propan-2-yloxyphenyl)carbonyl-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 6-iodanyl-3-(3-propan-2-yloxyphenyl)carbonyl-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 6-iodo-3-(3-isopropoxybenzoyl)-2-thioxo-1H-quinazolin-4-one CAS Name: 6-iodo-3-[oxo-(3-propan-2-yloxyphenyl)methyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 6-iodo-3-(3-propan-2-yloxybenzoyl)-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 6-iodo-3-(3-isopropoxybenzoyl)-2-thioxo-1H-quinazolin-4-one Formula: C18H15IN2O3S MolecularWeight: 466.29277

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)C(=O)N2C(=O)C3=C(C=CC(=C3)I)NC2=S

Isomeric SMILES

CC(C)OC1=CC=CC(=C1)C(=O)N2C(=O)C3=C(C=CC(=C3)I)NC2=S

InChI

InChI=1S/C18H15IN2O3S/c1-10(2)24-13-5-3-4-11(8-13)16(22)21-17(23)14-9-12(19)6-7-15(14)20-18(21)25/h3-10H,1-2H3,(H,20,25)