2-[2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl]sulfanyl-1H-quinazolin-4-one

Systemtic Name: 2-[2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl]sulfanyl-1H-quinazolin-4-one Openeye Name: 2-[2-(3,4-dimethylphenyl)-2-oxo-ethyl]sulfanyl-1H-quinazolin-4-one CAS Name: 2-[[2-(3,4-dimethylphenyl)-2-oxoethyl]thio]-1H-quinazolin-4-one IUPAC Name: 2-[2-(3,4-dimethylphenyl)-2-oxoethyl]sulfanyl-1H-quinazolin-4-one Traditional Name: 2-[[2-(3,4-dimethylphenyl)-2-keto-ethyl]thio]-1H-quinazolin-4-one Formula: C18H16N2O2S MolecularWeight: 324.39684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)CSC2=NC(=O)C3=CC=CC=C3N2)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)CSC2=NC(=O)C3=CC=CC=C3N2)C

InChI

InChI=1S/C18H16N2O2S/c1-11-7-8-13(9-12(11)2)16(21)10-23-18-19-15-6-4-3-5-14(15)17(22)20-18/h3-9H,10H2,1-2H3,(H,19,20,22)