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

Systemtic Name: 3-[2-[di(propan-2-yl)amino]ethyl]-2-[(4-pyrrolidin-1-ylcarbonylphenyl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-[2-(diisopropylamino)ethyl]-2-[[4-(pyrrolidine-1-carbonyl)phenyl]methylsulfanyl]quinazolin-4-one CAS Name: 3-[2-[di(propan-2-yl)amino]ethyl]-2-[[4-[oxo(1-pyrrolidinyl)methyl]phenyl]methylthio]-4-quinazolinone IUPAC Name: 3-[2-[di(propan-2-yl)amino]ethyl]-2-[[4-(pyrrolidine-1-carbonyl)phenyl]methylsulfanyl]quinazolin-4-one Traditional Name: 3-[2-(diisopropylamino)ethyl]-2-[[4-(pyrrolidine-1-carbonyl)benzyl]thio]quinazolin-4-one Formula: C28H36N4O2S MolecularWeight: 492.67604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC=C(C=C3)C(=O)N4CCCC4)C(C)C

Isomeric SMILES

CC(C)N(CCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC=C(C=C3)C(=O)N4CCCC4)C(C)C

InChI

InChI=1S/C28H36N4O2S/c1-20(2)31(21(3)4)17-18-32-27(34)24-9-5-6-10-25(24)29-28(32)35-19-22-11-13-23(14-12-22)26(33)30-15-7-8-16-30/h5-6,9-14,20-21H,7-8,15-19H2,1-4H3