3-(3-methoxyphenyl)-2-[(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-(3-methoxyphenyl)-2-[(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 2-[(6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methylsulfanyl]-3-(3-methoxyphenyl)quinazolin-4-one CAS Name: 3-(3-methoxyphenyl)-2-[(7-methyl-2-oxo-6-propan-2-yl-1-benzopyran-4-yl)methylthio]-4-quinazolinone IUPAC Name: 3-(3-methoxyphenyl)-2-[(7-methyl-2-oxo-6-propan-2-ylchromen-4-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 2-[(6-isopropyl-2-keto-7-methyl-chromen-4-yl)methylthio]-3-(3-methoxyphenyl)quinazolin-4-one Formula: C29H26N2O4S MolecularWeight: 498.59274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC(=CC=C5)OC)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC(=CC=C5)OC)C(C)C

InChI

InChI=1S/C29H26N2O4S/c1-17(2)23-15-24-19(13-27(32)35-26(24)12-18(23)3)16-36-29-30-25-11-6-5-10-22(25)28(33)31(29)20-8-7-9-21(14-20)34-4/h5-15,17H,16H2,1-4H3