N-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]-2-[6-iodanyl-4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]-2-[6-iodanyl-4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: 2-(3-benzyl-6-iodo-4-oxo-quinazolin-2-yl)sulfanyl-N-(2,5-dioxopyrrolidin-1-yl)acetamide CAS Name: N-(2,5-dioxo-1-pyrrolidinyl)-2-[[6-iodo-4-oxo-3-(phenylmethyl)-2-quinazolinyl]thio]acetamide IUPAC Name: 2-(3-benzyl-6-iodo-4-oxoquinazolin-2-yl)sulfanyl-N-(2,5-dioxopyrrolidin-1-yl)acetamide Traditional Name: 2-[(3-benzyl-6-iodo-4-keto-quinazolin-2-yl)thio]-N-succinimido-acetamide Formula: C21H17IN4O4S MolecularWeight: 548.35355

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1=O)NC(=O)CSC2=NC3=C(C=C(C=C3)I)C(=O)N2CC4=CC=CC=C4

Isomeric SMILES

C1CC(=O)N(C1=O)NC(=O)CSC2=NC3=C(C=C(C=C3)I)C(=O)N2CC4=CC=CC=C4

InChI

InChI=1S/C21H17IN4O4S/c22-14-6-7-16-15(10-14)20(30)25(11-13-4-2-1-3-5-13)21(23-16)31-12-17(27)24-26-18(28)8-9-19(26)29/h1-7,10H,8-9,11-12H2,(H,24,27)