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

Systemtic Name: 7-chloranyl-3-(2-methylpropyl)-2-[(3-oxidanylidenebenzo[f]chromen-1-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 7-chloro-3-isobutyl-2-[(3-oxobenzo[f]chromen-1-yl)methylsulfanyl]quinazolin-4-one CAS Name: 7-chloro-3-(2-methylpropyl)-2-[(3-oxo-1-benzo[f][1]benzopyranyl)methylthio]-4-quinazolinone IUPAC Name: 7-chloro-3-(2-methylpropyl)-2-[(3-oxobenzo[f]chromen-1-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 7-chloro-3-isobutyl-2-[(3-ketobenzo[f]chromen-1-yl)methylthio]quinazolin-4-one Formula: C26H21ClN2O3S MolecularWeight: 476.97454

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC3=CC(=O)OC4=C3C5=CC=CC=C5C=C4

Isomeric SMILES

CC(C)CN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC3=CC(=O)OC4=C3C5=CC=CC=C5C=C4

InChI

InChI=1S/C26H21ClN2O3S/c1-15(2)13-29-25(31)20-9-8-18(27)12-21(20)28-26(29)33-14-17-11-23(30)32-22-10-7-16-5-3-4-6-19(16)24(17)22/h3-12,15H,13-14H2,1-2H3