3-cyclopropyl-2-[2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-cyclopropyl-2-[2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl]sulfanyl-quinazolin-4-one Openeye Name: 3-cyclopropyl-2-[2-(3,4-dimethylphenyl)-2-oxo-ethyl]sulfanyl-quinazolin-4-one CAS Name: 3-cyclopropyl-2-[[2-(3,4-dimethylphenyl)-2-oxoethyl]thio]-4-quinazolinone IUPAC Name: 3-cyclopropyl-2-[2-(3,4-dimethylphenyl)-2-oxoethyl]sulfanylquinazolin-4-one Traditional Name: 3-cyclopropyl-2-[[2-(3,4-dimethylphenyl)-2-keto-ethyl]thio]quinazolin-4-one Formula: C21H20N2O2S MolecularWeight: 364.4607

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4CC4)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4CC4)C

InChI

InChI=1S/C21H20N2O2S/c1-13-7-8-15(11-14(13)2)19(24)12-26-21-22-18-6-4-3-5-17(18)20(25)23(21)16-9-10-16/h3-8,11,16H,9-10,12H2,1-2H3