3-[2-[di(propan-2-yl)amino]ethyl]-2-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-[2-[di(propan-2-yl)amino]ethyl]-2-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-[2-(diisopropylamino)ethyl]-2-[(7-methoxy-2-oxo-chromen-4-yl)methylsulfanyl]quinazolin-4-one CAS Name: 3-[2-[di(propan-2-yl)amino]ethyl]-2-[(7-methoxy-2-oxo-1-benzopyran-4-yl)methylthio]-4-quinazolinone IUPAC Name: 3-[2-[di(propan-2-yl)amino]ethyl]-2-[(7-methoxy-2-oxochromen-4-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-[2-(diisopropylamino)ethyl]-2-[(2-keto-7-methoxy-chromen-4-yl)methylthio]quinazolin-4-one Formula: C27H31N3O4S MolecularWeight: 493.61774

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC(=O)OC4=C3C=CC(=C4)OC)C(C)C

Isomeric SMILES

CC(C)N(CCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC(=O)OC4=C3C=CC(=C4)OC)C(C)C

InChI

InChI=1S/C27H31N3O4S/c1-17(2)29(18(3)4)12-13-30-26(32)22-8-6-7-9-23(22)28-27(30)35-16-19-14-25(31)34-24-15-20(33-5)10-11-21(19)24/h6-11,14-15,17-18H,12-13,16H2,1-5H3