N-[6-bromanyl-2-[4-methoxy-3-(pyridin-2-ylsulfanylmethyl)phenyl]-4-oxidanylidene-1,2-dihydroquinazolin-3-yl]-4-chloranyl-benzamide

Systemtic Name: N-[6-bromanyl-2-[4-methoxy-3-(pyridin-2-ylsulfanylmethyl)phenyl]-4-oxidanylidene-1,2-dihydroquinazolin-3-yl]-4-chloranyl-benzamide Openeye Name: N-[6-bromo-2-[4-methoxy-3-(2-pyridylsulfanylmethyl)phenyl]-4-oxo-1,2-dihydroquinazolin-3-yl]-4-chloro-benzamide CAS Name: N-[6-bromo-2-[4-methoxy-3-[(2-pyridinylthio)methyl]phenyl]-4-oxo-1,2-dihydroquinazolin-3-yl]-4-chlorobenzamide IUPAC Name: N-[6-bromo-2-[4-methoxy-3-(pyridin-2-ylsulfanylmethyl)phenyl]-4-oxo-1,2-dihydroquinazolin-3-yl]-4-chlorobenzamide Traditional Name: N-[6-bromo-4-keto-2-[4-methoxy-3-[(2-pyridylthio)methyl]phenyl]-1,2-dihydroquinazolin-3-yl]-4-chloro-benzamide Formula: C28H22BrClN4O3S MolecularWeight: 609.92128

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2NC3=C(C=C(C=C3)Br)C(=O)N2NC(=O)C4=CC=C(C=C4)Cl)CSC5=CC=CC=N5

Isomeric SMILES

COC1=C(C=C(C=C1)C2NC3=C(C=C(C=C3)Br)C(=O)N2NC(=O)C4=CC=C(C=C4)Cl)CSC5=CC=CC=N5

InChI

InChI=1S/C28H22BrClN4O3S/c1-37-24-12-7-18(14-19(24)16-38-25-4-2-3-13-31-25)26-32-23-11-8-20(29)15-22(23)28(36)34(26)33-27(35)17-5-9-21(30)10-6-17/h2-15,26,32H,16H2,1H3,(H,33,35)