2-[(5-chloranyl-1-benzothiophen-3-yl)methylsulfanyl]-3-[2-(3,4-dimethoxyphenyl)ethyl]quinazolin-4-one

Systemtic Name: 2-[(5-chloranyl-1-benzothiophen-3-yl)methylsulfanyl]-3-[2-(3,4-dimethoxyphenyl)ethyl]quinazolin-4-one Openeye Name: 2-[(5-chlorobenzothiophen-3-yl)methylsulfanyl]-3-[2-(3,4-dimethoxyphenyl)ethyl]quinazolin-4-one CAS Name: 2-[(5-chloro-1-benzothiophen-3-yl)methylthio]-3-[2-(3,4-dimethoxyphenyl)ethyl]-4-quinazolinone IUPAC Name: 2-[(5-chloro-1-benzothiophen-3-yl)methylsulfanyl]-3-[2-(3,4-dimethoxyphenyl)ethyl]quinazolin-4-one Traditional Name: 2-[(5-chlorobenzothiophen-3-yl)methylthio]-3-homoveratryl-quinazolin-4-one Formula: C27H23ClN2O3S2 MolecularWeight: 523.06612

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2C(=O)C3=CC=CC=C3N=C2SCC4=CSC5=C4C=C(C=C5)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2C(=O)C3=CC=CC=C3N=C2SCC4=CSC5=C4C=C(C=C5)Cl)OC

InChI

InChI=1S/C27H23ClN2O3S2/c1-32-23-9-7-17(13-24(23)33-2)11-12-30-26(31)20-5-3-4-6-22(20)29-27(30)35-16-18-15-34-25-10-8-19(28)14-21(18)25/h3-10,13-15H,11-12,16H2,1-2H3