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

Systemtic Name: 4-[3-(3-chloranyl-2-methyl-phenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-2-(4-methyl-1,3-thiazol-2-yl)-3-oxidanylidene-butanenitrile Openeye Name: 4-[3-(3-chloro-2-methyl-phenyl)-4-oxo-quinazolin-2-yl]sulfanyl-2-(4-methylthiazol-2-yl)-3-oxo-butanenitrile CAS Name: 4-[[3-(3-chloro-2-methylphenyl)-4-oxo-2-quinazolinyl]thio]-2-(4-methyl-2-thiazolyl)-3-oxobutanenitrile IUPAC Name: 4-[3-(3-chloro-2-methylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-2-(4-methyl-1,3-thiazol-2-yl)-3-oxobutanenitrile Traditional Name: 4-[[3-(3-chloro-2-methyl-phenyl)-4-keto-quinazolin-2-yl]thio]-3-keto-2-(4-methylthiazol-2-yl)butyronitrile Formula: C23H17ClN4O2S2 MolecularWeight: 480.98968

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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=C(C(=CC=C4)Cl)C

Isomeric SMILES

CC1=CSC(=N1)C(C#N)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=C(C(=CC=C4)Cl)C

InChI

InChI=1S/C23H17ClN4O2S2/c1-13-11-31-21(26-13)16(10-25)20(29)12-32-23-27-18-8-4-3-6-15(18)22(30)28(23)19-9-5-7-17(24)14(19)2/h3-9,11,16H,12H2,1-2H3