2-[(7-chloranyl-4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanylmethyl]isoindole-1,3-dione

Systemtic Name: 2-[(7-chloranyl-4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanylmethyl]isoindole-1,3-dione Openeye Name: 2-[(7-chloro-3-isopropyl-4-oxo-quinazolin-2-yl)sulfanylmethyl]isoindoline-1,3-dione CAS Name: 2-[[(7-chloro-4-oxo-3-propan-2-yl-2-quinazolinyl)thio]methyl]isoindole-1,3-dione IUPAC Name: 2-[(7-chloro-4-oxo-3-propan-2-ylquinazolin-2-yl)sulfanylmethyl]isoindole-1,3-dione Traditional Name: 2-[[(7-chloro-3-isopropyl-4-keto-quinazolin-2-yl)thio]methyl]isoindoline-1,3-quinone Formula: C20H16ClN3O3S MolecularWeight: 413.87734

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC(C)N1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C20H16ClN3O3S/c1-11(2)24-19(27)15-8-7-12(21)9-16(15)22-20(24)28-10-23-17(25)13-5-3-4-6-14(13)18(23)26/h3-9,11H,10H2,1-2H3