7-chloranyl-3-(3-methylbutyl)-2-[(3-oxidanylidenebenzo[f]chromen-1-yl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 7-chloranyl-3-(3-methylbutyl)-2-[(3-oxidanylidenebenzo[f]chromen-1-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 7-chloro-3-isopentyl-2-[(3-oxobenzo[f]chromen-1-yl)methylsulfanyl]quinazolin-4-one CAS Name: 7-chloro-3-(3-methylbutyl)-2-[(3-oxo-1-benzo[f][1]benzopyranyl)methylthio]-4-quinazolinone IUPAC Name: 7-chloro-3-(3-methylbutyl)-2-[(3-oxobenzo[f]chromen-1-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 7-chloro-3-isoamyl-2-[(3-ketobenzo[f]chromen-1-yl)methylthio]quinazolin-4-one Formula: C27H23ClN2O3S MolecularWeight: 491.00112

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC3=CC(=O)OC4=C3C5=CC=CC=C5C=C4

Isomeric SMILES

CC(C)CCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC3=CC(=O)OC4=C3C5=CC=CC=C5C=C4

InChI

InChI=1S/C27H23ClN2O3S/c1-16(2)11-12-30-26(32)21-9-8-19(28)14-22(21)29-27(30)34-15-18-13-24(31)33-23-10-7-17-5-3-4-6-20(17)25(18)23/h3-10,13-14,16H,11-12,15H2,1-2H3