6-iodanyl-3-(phenylmethyl)-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 6-iodanyl-3-(phenylmethyl)-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-benzyl-6-iodo-2-thioxo-1H-quinazolin-4-one CAS Name: 6-iodo-3-(phenylmethyl)-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-benzyl-6-iodo-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-benzyl-6-iodo-2-thioxo-1H-quinazolin-4-one Formula: C15H11IN2OS MolecularWeight: 394.23011

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=C(C=CC(=C3)I)NC2=S

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=C(C=CC(=C3)I)NC2=S

InChI

InChI=1S/C15H11IN2OS/c16-11-6-7-13-12(8-11)14(19)18(15(20)17-13)9-10-4-2-1-3-5-10/h1-8H,9H2,(H,17,20)