2-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-3-[(3,4-dimethoxyphenyl)methyl]quinazolin-4-one

Systemtic Name: 2-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-3-[(3,4-dimethoxyphenyl)methyl]quinazolin-4-one Openeye Name: 2-[2-(4-chlorophenyl)-2-oxo-ethyl]sulfanyl-3-[(3,4-dimethoxyphenyl)methyl]quinazolin-4-one CAS Name: 2-[[2-(4-chlorophenyl)-2-oxoethyl]thio]-3-[(3,4-dimethoxyphenyl)methyl]-4-quinazolinone IUPAC Name: 2-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-3-[(3,4-dimethoxyphenyl)methyl]quinazolin-4-one Traditional Name: 2-[[2-(4-chlorophenyl)-2-keto-ethyl]thio]-3-veratryl-quinazolin-4-one Formula: C25H21ClN2O4S MolecularWeight: 480.96324

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=CC=C(C=C4)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=CC=C(C=C4)Cl)OC

InChI

InChI=1S/C25H21ClN2O4S/c1-31-22-12-7-16(13-23(22)32-2)14-28-24(30)19-5-3-4-6-20(19)27-25(28)33-15-21(29)17-8-10-18(26)11-9-17/h3-13H,14-15H2,1-2H3