7-chloranyl-2-[(8-methyl-4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]-3-(3-propan-2-yloxypropyl)quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[(8-methyl-4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]-3-(3-propan-2-yloxypropyl)quinazolin-4-one Openeye Name: 7-chloro-3-(3-isopropoxypropyl)-2-[(8-methyl-4-oxo-1H-quinazolin-2-yl)methylsulfanyl]quinazolin-4-one CAS Name: 7-chloro-2-[(8-methyl-4-oxo-1H-quinazolin-2-yl)methylthio]-3-(3-propan-2-yloxypropyl)-4-quinazolinone IUPAC Name: 7-chloro-2-[(8-methyl-4-oxo-1H-quinazolin-2-yl)methylsulfanyl]-3-(3-propan-2-yloxypropyl)quinazolin-4-one Traditional Name: 7-chloro-3-(3-isopropoxypropyl)-2-[(4-keto-8-methyl-1H-quinazolin-2-yl)methylthio]quinazolin-4-one Formula: C24H25ClN4O3S MolecularWeight: 484.9983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC(=NC2=O)CSC3=NC4=C(C=CC(=C4)Cl)C(=O)N3CCCOC(C)C

Isomeric SMILES

CC1=CC=CC2=C1NC(=NC2=O)CSC3=NC4=C(C=CC(=C4)Cl)C(=O)N3CCCOC(C)C

InChI

InChI=1S/C24H25ClN4O3S/c1-14(2)32-11-5-10-29-23(31)17-9-8-16(25)12-19(17)26-24(29)33-13-20-27-21-15(3)6-4-7-18(21)22(30)28-20/h4,6-9,12,14H,5,10-11,13H2,1-3H3,(H,27,28,30)