6-chloranyl-2-[(2,5-dimethoxyphenyl)methylsulfanyl]-3-prop-2-enyl-quinazolin-4-one

Systemtic Name: 6-chloranyl-2-[(2,5-dimethoxyphenyl)methylsulfanyl]-3-prop-2-enyl-quinazolin-4-one Openeye Name: 3-allyl-6-chloro-2-[(2,5-dimethoxyphenyl)methylsulfanyl]quinazolin-4-one CAS Name: 6-chloro-2-[(2,5-dimethoxyphenyl)methylthio]-3-prop-2-enyl-4-quinazolinone IUPAC Name: 6-chloro-2-[(2,5-dimethoxyphenyl)methylsulfanyl]-3-prop-2-enylquinazolin-4-one Traditional Name: 3-allyl-6-chloro-2-[(2,5-dimethoxybenzyl)thio]quinazolin-4-one Formula: C20H19ClN2O3S MolecularWeight: 402.89446

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CSC2=NC3=C(C=C(C=C3)Cl)C(=O)N2CC=C

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CSC2=NC3=C(C=C(C=C3)Cl)C(=O)N2CC=C

InChI

InChI=1S/C20H19ClN2O3S/c1-4-9-23-19(24)16-11-14(21)5-7-17(16)22-20(23)27-12-13-10-15(25-2)6-8-18(13)26-3/h4-8,10-11H,1,9,12H2,2-3H3