7-chloranyl-2-[(3-methoxyphenyl)methylsulfanyl]-3-(3-methylbutyl)quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[(3-methoxyphenyl)methylsulfanyl]-3-(3-methylbutyl)quinazolin-4-one Openeye Name: 7-chloro-3-isopentyl-2-[(3-methoxyphenyl)methylsulfanyl]quinazolin-4-one CAS Name: 7-chloro-2-[(3-methoxyphenyl)methylthio]-3-(3-methylbutyl)-4-quinazolinone IUPAC Name: 7-chloro-2-[(3-methoxyphenyl)methylsulfanyl]-3-(3-methylbutyl)quinazolin-4-one Traditional Name: 7-chloro-3-isoamyl-2-(m-anisylthio)quinazolin-4-one Formula: C21H23ClN2O2S MolecularWeight: 402.93752

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC3=CC(=CC=C3)OC

Isomeric SMILES

CC(C)CCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC3=CC(=CC=C3)OC

InChI

InChI=1S/C21H23ClN2O2S/c1-14(2)9-10-24-20(25)18-8-7-16(22)12-19(18)23-21(24)27-13-15-5-4-6-17(11-15)26-3/h4-8,11-12,14H,9-10,13H2,1-3H3