3-(3-chloranyl-4-methoxy-phenyl)-2-[2-(2,5-dimethylphenyl)-2-oxidanylidene-ethyl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-(3-chloranyl-4-methoxy-phenyl)-2-[2-(2,5-dimethylphenyl)-2-oxidanylidene-ethyl]sulfanyl-quinazolin-4-one Openeye Name: 3-(3-chloro-4-methoxy-phenyl)-2-[2-(2,5-dimethylphenyl)-2-oxo-ethyl]sulfanyl-quinazolin-4-one CAS Name: 3-(3-chloro-4-methoxyphenyl)-2-[[2-(2,5-dimethylphenyl)-2-oxoethyl]thio]-4-quinazolinone IUPAC Name: 3-(3-chloro-4-methoxyphenyl)-2-[2-(2,5-dimethylphenyl)-2-oxoethyl]sulfanylquinazolin-4-one Traditional Name: 3-(3-chloro-4-methoxy-phenyl)-2-[[2-(2,5-dimethylphenyl)-2-keto-ethyl]thio]quinazolin-4-one Formula: C25H21ClN2O3S MolecularWeight: 464.96384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC(=C(C=C4)OC)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC(=C(C=C4)OC)Cl

InChI

InChI=1S/C25H21ClN2O3S/c1-15-8-9-16(2)19(12-15)22(29)14-32-25-27-21-7-5-4-6-18(21)24(30)28(25)17-10-11-23(31-3)20(26)13-17/h4-13H,14H2,1-3H3