3-(4-tert-butylphenyl)carbonyl-6-iodanyl-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-(4-tert-butylphenyl)carbonyl-6-iodanyl-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-(4-tert-butylbenzoyl)-6-iodo-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[(4-tert-butylphenyl)-oxomethyl]-6-iodo-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-(4-tert-butylbenzoyl)-6-iodo-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-(4-tert-butylbenzoyl)-6-iodo-2-thioxo-1H-quinazolin-4-one Formula: C19H17IN2O2S MolecularWeight: 464.31995

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17IN2O2S/c1-19(2,3)12-6-4-11(5-7-12)16(23)22-17(24)14-10-13(20)8-9-15(14)21-18(22)25/h4-10H,1-3H3,(H,21,25)