2-[(Z)-2-(5-bromanylthiophen-2-yl)-1-chloranyl-ethenyl]-6,7-dimethoxy-1H-quinazolin-4-one

Systemtic Name: 2-[(Z)-2-(5-bromanylthiophen-2-yl)-1-chloranyl-ethenyl]-6,7-dimethoxy-1H-quinazolin-4-one Openeye Name: 2-[(Z)-2-(5-bromo-2-thienyl)-1-chloro-vinyl]-6,7-dimethoxy-1H-quinazolin-4-one CAS Name: 2-[(Z)-2-(5-bromo-2-thiophenyl)-1-chloroethenyl]-6,7-dimethoxy-1H-quinazolin-4-one IUPAC Name: 2-[(Z)-2-(5-bromothiophen-2-yl)-1-chloroethenyl]-6,7-dimethoxy-1H-quinazolin-4-one Traditional Name: 2-[(Z)-2-(5-bromo-2-thienyl)-1-chloro-vinyl]-6,7-dimethoxy-1H-quinazolin-4-one Formula: C16H12BrClN2O3S MolecularWeight: 427.70008

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)N=C(N2)C(=CC3=CC=C(S3)Br)Cl)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)N=C(N2)/C(=C/C3=CC=C(S3)Br)/Cl)OC

InChI

InChI=1S/C16H12BrClN2O3S/c1-22-12-6-9-11(7-13(12)23-2)19-15(20-16(9)21)10(18)5-8-3-4-14(17)24-8/h3-7H,1-2H3,(H,19,20,21)/b10-5-