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

Systemtic Name: 2-[(6-chloranyl-7-ethyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-3-cyclopropyl-quinazolin-4-one Openeye Name: 2-[(6-chloro-7-ethyl-2-oxo-chromen-4-yl)methylsulfanyl]-3-cyclopropyl-quinazolin-4-one CAS Name: 2-[(6-chloro-7-ethyl-2-oxo-1-benzopyran-4-yl)methylthio]-3-cyclopropyl-4-quinazolinone IUPAC Name: 2-[(6-chloro-7-ethyl-2-oxochromen-4-yl)methylsulfanyl]-3-cyclopropylquinazolin-4-one Traditional Name: 2-[(6-chloro-7-ethyl-2-keto-chromen-4-yl)methylthio]-3-cyclopropyl-quinazolin-4-one Formula: C23H19ClN2O3S MolecularWeight: 438.92656

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NC4=CC=CC=C4C(=O)N3C5CC5)Cl

Isomeric SMILES

CCC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NC4=CC=CC=C4C(=O)N3C5CC5)Cl

InChI

InChI=1S/C23H19ClN2O3S/c1-2-13-9-20-17(11-18(13)24)14(10-21(27)29-20)12-30-23-25-19-6-4-3-5-16(19)22(28)26(23)15-7-8-15/h3-6,9-11,15H,2,7-8,12H2,1H3