3-propan-2-yl-2-[(4-pyrrolidin-1-ylcarbonylphenyl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-propan-2-yl-2-[(4-pyrrolidin-1-ylcarbonylphenyl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-isopropyl-2-[[4-(pyrrolidine-1-carbonyl)phenyl]methylsulfanyl]quinazolin-4-one CAS Name: 2-[[4-[oxo(1-pyrrolidinyl)methyl]phenyl]methylthio]-3-propan-2-yl-4-quinazolinone IUPAC Name: 3-propan-2-yl-2-[[4-(pyrrolidine-1-carbonyl)phenyl]methylsulfanyl]quinazolin-4-one Traditional Name: 3-isopropyl-2-[[4-(pyrrolidine-1-carbonyl)benzyl]thio]quinazolin-4-one Formula: C23H25N3O2S MolecularWeight: 407.5285

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2N=C1SCC3=CC=C(C=C3)C(=O)N4CCCC4

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2N=C1SCC3=CC=C(C=C3)C(=O)N4CCCC4

InChI

InChI=1S/C23H25N3O2S/c1-16(2)26-22(28)19-7-3-4-8-20(19)24-23(26)29-15-17-9-11-18(12-10-17)21(27)25-13-5-6-14-25/h3-4,7-12,16H,5-6,13-15H2,1-2H3