7-chloranyl-2-[(6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-3-(2-methoxyethyl)quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[(6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-3-(2-methoxyethyl)quinazolin-4-one Openeye Name: 7-chloro-2-[(6-ethyl-7-hydroxy-2-oxo-chromen-4-yl)methylsulfanyl]-3-(2-methoxyethyl)quinazolin-4-one CAS Name: 7-chloro-2-[(6-ethyl-7-hydroxy-2-oxo-1-benzopyran-4-yl)methylthio]-3-(2-methoxyethyl)-4-quinazolinone IUPAC Name: 7-chloro-2-[(6-ethyl-7-hydroxy-2-oxochromen-4-yl)methylsulfanyl]-3-(2-methoxyethyl)quinazolin-4-one Traditional Name: 7-chloro-2-[(6-ethyl-7-hydroxy-2-keto-chromen-4-yl)methylthio]-3-(2-methoxyethyl)quinazolin-4-one Formula: C23H21ClN2O5S MolecularWeight: 472.94124

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC3=NC4=C(C=CC(=C4)Cl)C(=O)N3CCOC)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC3=NC4=C(C=CC(=C4)Cl)C(=O)N3CCOC)O

InChI

InChI=1S/C23H21ClN2O5S/c1-3-13-8-17-14(9-21(28)31-20(17)11-19(13)27)12-32-23-25-18-10-15(24)4-5-16(18)22(29)26(23)6-7-30-2/h4-5,8-11,27H,3,6-7,12H2,1-2H3