2-[3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(3-methylsulfanylphenyl)ethanamide

Systemtic Name: 2-[3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(3-methylsulfanylphenyl)ethanamide Openeye Name: 2-(3-isobutyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(3-methylsulfanylphenyl)acetamide CAS Name: 2-[[3-(2-methylpropyl)-4-oxo-2-quinazolinyl]thio]-N-[3-(methylthio)phenyl]acetamide IUPAC Name: 2-[3-(2-methylpropyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(3-methylsulfanylphenyl)acetamide Traditional Name: 2-[(3-isobutyl-4-keto-quinazolin-2-yl)thio]-N-[3-(methylthio)phenyl]acetamide Formula: C21H23N3O2S2 MolecularWeight: 413.55622

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=CC(=CC=C3)SC

Isomeric SMILES

CC(C)CN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=CC(=CC=C3)SC

InChI

InChI=1S/C21H23N3O2S2/c1-14(2)12-24-20(26)17-9-4-5-10-18(17)23-21(24)28-13-19(25)22-15-7-6-8-16(11-15)27-3/h4-11,14H,12-13H2,1-3H3,(H,22,25)