6-chloranyl-3-(2-methylpropyl)-2-[(4-pyrrolidin-1-ylcarbonylphenyl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 6-chloranyl-3-(2-methylpropyl)-2-[(4-pyrrolidin-1-ylcarbonylphenyl)methylsulfanyl]quinazolin-4-one Openeye Name: 6-chloro-3-isobutyl-2-[[4-(pyrrolidine-1-carbonyl)phenyl]methylsulfanyl]quinazolin-4-one CAS Name: 6-chloro-3-(2-methylpropyl)-2-[[4-[oxo(1-pyrrolidinyl)methyl]phenyl]methylthio]-4-quinazolinone IUPAC Name: 6-chloro-3-(2-methylpropyl)-2-[[4-(pyrrolidine-1-carbonyl)phenyl]methylsulfanyl]quinazolin-4-one Traditional Name: 6-chloro-3-isobutyl-2-[[4-(pyrrolidine-1-carbonyl)benzyl]thio]quinazolin-4-one Formula: C24H26ClN3O2S MolecularWeight: 456.00014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C=CC(=C2)Cl)N=C1SCC3=CC=C(C=C3)C(=O)N4CCCC4

Isomeric SMILES

CC(C)CN1C(=O)C2=C(C=CC(=C2)Cl)N=C1SCC3=CC=C(C=C3)C(=O)N4CCCC4

InChI

InChI=1S/C24H26ClN3O2S/c1-16(2)14-28-23(30)20-13-19(25)9-10-21(20)26-24(28)31-15-17-5-7-18(8-6-17)22(29)27-11-3-4-12-27/h5-10,13,16H,3-4,11-12,14-15H2,1-2H3