2-[3-(2-dimethylaminoethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(4-methylsulfonylphenyl)ethanamide

Systemtic Name: 2-[3-(2-dimethylaminoethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(4-methylsulfonylphenyl)ethanamide Openeye Name: 2-[3-(2-dimethylaminoethyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(4-methylsulfonylphenyl)acetamide CAS Name: 2-[[3-(2-dimethylaminoethyl)-4-oxo-2-quinazolinyl]thio]-N-(4-methylsulfonylphenyl)acetamide IUPAC Name: 2-[3-(2-dimethylaminoethyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(4-methylsulfonylphenyl)acetamide Traditional Name: 2-[[3-(2-dimethylaminoethyl)-4-keto-quinazolin-2-yl]thio]-N-(4-mesylphenyl)acetamide Formula: C21H24N4O4S2 MolecularWeight: 460.56966

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CN(C)CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C21H24N4O4S2/c1-24(2)12-13-25-20(27)17-6-4-5-7-18(17)23-21(25)30-14-19(26)22-15-8-10-16(11-9-15)31(3,28)29/h4-11H,12-14H2,1-3H3,(H,22,26)