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

Systemtic Name: 2-[(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methylsulfanyl]-3-(2-methylphenyl)quinazolin-4-one Openeye Name: 2-[(6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methylsulfanyl]-3-(o-tolyl)quinazolin-4-one CAS Name: 2-[(7-methyl-2-oxo-6-propan-2-yl-1-benzopyran-4-yl)methylthio]-3-(2-methylphenyl)-4-quinazolinone IUPAC Name: 2-[(7-methyl-2-oxo-6-propan-2-ylchromen-4-yl)methylsulfanyl]-3-(2-methylphenyl)quinazolin-4-one Traditional Name: 2-[(6-isopropyl-2-keto-7-methyl-chromen-4-yl)methylthio]-3-(o-tolyl)quinazolin-4-one Formula: C29H26N2O3S MolecularWeight: 482.59334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCC4=CC(=O)OC5=CC(=C(C=C45)C(C)C)C

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCC4=CC(=O)OC5=CC(=C(C=C45)C(C)C)C

InChI

InChI=1S/C29H26N2O3S/c1-17(2)22-15-23-20(14-27(32)34-26(23)13-19(22)4)16-35-29-30-24-11-7-6-10-21(24)28(33)31(29)25-12-8-5-9-18(25)3/h5-15,17H,16H2,1-4H3