6,8-bis(chloranyl)-3-[2-oxidanylidene-2-(2-thiophen-2-ylpyrrolidin-1-yl)ethyl]quinazolin-4-one

Systemtic Name: 6,8-bis(chloranyl)-3-[2-oxidanylidene-2-(2-thiophen-2-ylpyrrolidin-1-yl)ethyl]quinazolin-4-one Openeye Name: 6,8-dichloro-3-[2-oxo-2-[2-(2-thienyl)pyrrolidin-1-yl]ethyl]quinazolin-4-one CAS Name: 6,8-dichloro-3-[2-oxo-2-(2-thiophen-2-yl-1-pyrrolidinyl)ethyl]-4-quinazolinone IUPAC Name: 6,8-dichloro-3-[2-oxo-2-(2-thiophen-2-ylpyrrolidin-1-yl)ethyl]quinazolin-4-one Traditional Name: 6,8-dichloro-3-[2-keto-2-[2-(2-thienyl)pyrrolidino]ethyl]quinazolin-4-one Formula: C18H15Cl2N3O2S MolecularWeight: 408.3016

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CN2C=NC3=C(C=C(C=C3C2=O)Cl)Cl)C4=CC=CS4

Isomeric SMILES

C1CC(N(C1)C(=O)CN2C=NC3=C(C=C(C=C3C2=O)Cl)Cl)C4=CC=CS4

InChI

InChI=1S/C18H15Cl2N3O2S/c19-11-7-12-17(13(20)8-11)21-10-22(18(12)25)9-16(24)23-5-1-3-14(23)15-4-2-6-26-15/h2,4,6-8,10,14H,1,3,5,9H2