2-(4-methyl-1,3-thiazol-2-yl)-3-oxidanylidene-4-[4-oxidanylidene-3-(2-propan-2-ylphenyl)quinazolin-2-yl]sulfanyl-butanenitrile

Systemtic Name: 2-(4-methyl-1,3-thiazol-2-yl)-3-oxidanylidene-4-[4-oxidanylidene-3-(2-propan-2-ylphenyl)quinazolin-2-yl]sulfanyl-butanenitrile Openeye Name: 4-[3-(2-isopropylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-2-(4-methylthiazol-2-yl)-3-oxo-butanenitrile CAS Name: 2-(4-methyl-2-thiazolyl)-3-oxo-4-[[4-oxo-3-(2-propan-2-ylphenyl)-2-quinazolinyl]thio]butanenitrile IUPAC Name: 2-(4-methyl-1,3-thiazol-2-yl)-3-oxo-4-[4-oxo-3-(2-propan-2-ylphenyl)quinazolin-2-yl]sulfanylbutanenitrile Traditional Name: 3-keto-4-[(4-keto-3-o-cumenyl-quinazolin-2-yl)thio]-2-(4-methylthiazol-2-yl)butyronitrile Formula: C25H22N4O2S2 MolecularWeight: 474.59778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)C(C#N)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4C(C)C

Isomeric SMILES

CC1=CSC(=N1)C(C#N)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4C(C)C

InChI

InChI=1S/C25H22N4O2S2/c1-15(2)17-8-5-7-11-21(17)29-24(31)18-9-4-6-10-20(18)28-25(29)33-14-22(30)19(12-26)23-27-16(3)13-32-23/h4-11,13,15,19H,14H2,1-3H3