3-(3,4-dimethoxyphenyl)-2-(2-oxidanylidenecyclohexyl)sulfanyl-quinazolin-4-one

Systemtic Name: 3-(3,4-dimethoxyphenyl)-2-(2-oxidanylidenecyclohexyl)sulfanyl-quinazolin-4-one Openeye Name: 3-(3,4-dimethoxyphenyl)-2-(2-oxocyclohexyl)sulfanyl-quinazolin-4-one CAS Name: 3-(3,4-dimethoxyphenyl)-2-[(2-oxocyclohexyl)thio]-4-quinazolinone IUPAC Name: 3-(3,4-dimethoxyphenyl)-2-(2-oxocyclohexyl)sulfanylquinazolin-4-one Traditional Name: 3-(3,4-dimethoxyphenyl)-2-[(2-ketocyclohexyl)thio]quinazolin-4-one Formula: C22H22N2O4S MolecularWeight: 410.48608

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC4CCCCC4=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC4CCCCC4=O)OC

InChI

InChI=1S/C22H22N2O4S/c1-27-18-12-11-14(13-19(18)28-2)24-21(26)15-7-3-4-8-16(15)23-22(24)29-20-10-6-5-9-17(20)25/h3-4,7-8,11-13,20H,5-6,9-10H2,1-2H3