6-iodanyl-2-(2-oxidanylidenepyrrolidin-3-yl)sulfanyl-3-(phenylmethyl)quinazolin-4-one

Systemtic Name: 6-iodanyl-2-(2-oxidanylidenepyrrolidin-3-yl)sulfanyl-3-(phenylmethyl)quinazolin-4-one Openeye Name: 3-benzyl-6-iodo-2-(2-oxopyrrolidin-3-yl)sulfanyl-quinazolin-4-one CAS Name: 6-iodo-2-[(2-oxo-3-pyrrolidinyl)thio]-3-(phenylmethyl)-4-quinazolinone IUPAC Name: 3-benzyl-6-iodo-2-(2-oxopyrrolidin-3-yl)sulfanylquinazolin-4-one Traditional Name: 3-benzyl-6-iodo-2-[(2-ketopyrrolidin-3-yl)thio]quinazolin-4-one Formula: C19H16IN3O2S MolecularWeight: 477.31871

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(=O)C1SC2=NC3=C(C=C(C=C3)I)C(=O)N2CC4=CC=CC=C4

Isomeric SMILES

C1CNC(=O)C1SC2=NC3=C(C=C(C=C3)I)C(=O)N2CC4=CC=CC=C4

InChI

InChI=1S/C19H16IN3O2S/c20-13-6-7-15-14(10-13)18(25)23(11-12-4-2-1-3-5-12)19(22-15)26-16-8-9-21-17(16)24/h1-7,10,16H,8-9,11H2,(H,21,24)