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

Systemtic Name: 2-[(6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-3-(3-propan-2-yloxypropyl)quinazolin-4-one Openeye Name: 2-[(6-chloro-7-methyl-2-oxo-chromen-4-yl)methylsulfanyl]-3-(3-isopropoxypropyl)quinazolin-4-one CAS Name: 2-[(6-chloro-7-methyl-2-oxo-1-benzopyran-4-yl)methylthio]-3-(3-propan-2-yloxypropyl)-4-quinazolinone IUPAC Name: 2-[(6-chloro-7-methyl-2-oxochromen-4-yl)methylsulfanyl]-3-(3-propan-2-yloxypropyl)quinazolin-4-one Traditional Name: 2-[(6-chloro-2-keto-7-methyl-chromen-4-yl)methylthio]-3-(3-isopropoxypropyl)quinazolin-4-one Formula: C25H25ClN2O4S MolecularWeight: 484.995

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NC4=CC=CC=C4C(=O)N3CCCOC(C)C)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NC4=CC=CC=C4C(=O)N3CCCOC(C)C)Cl

InChI

InChI=1S/C25H25ClN2O4S/c1-15(2)31-10-6-9-28-24(30)18-7-4-5-8-21(18)27-25(28)33-14-17-12-23(29)32-22-11-16(3)20(26)13-19(17)22/h4-5,7-8,11-13,15H,6,9-10,14H2,1-3H3