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

Systemtic Name: 3-butyl-2-[(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-butyl-2-[(6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methylsulfanyl]quinazolin-4-one CAS Name: 3-butyl-2-[(7-methyl-2-oxo-6-propan-2-yl-1-benzopyran-4-yl)methylthio]-4-quinazolinone IUPAC Name: 3-butyl-2-[(7-methyl-2-oxo-6-propan-2-ylchromen-4-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-butyl-2-[(6-isopropyl-2-keto-7-methyl-chromen-4-yl)methylthio]quinazolin-4-one Formula: C26H28N2O3S MolecularWeight: 448.57712

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC(=O)OC4=CC(=C(C=C34)C(C)C)C

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC(=O)OC4=CC(=C(C=C34)C(C)C)C

InChI

InChI=1S/C26H28N2O3S/c1-5-6-11-28-25(30)19-9-7-8-10-22(19)27-26(28)32-15-18-13-24(29)31-23-12-17(4)20(16(2)3)14-21(18)23/h7-10,12-14,16H,5-6,11,15H2,1-4H3