2-[7-chloranyl-3-(2-methoxy-5-methyl-phenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(2S)-2-cyano-3-methyl-butan-2-yl]ethanamide

Systemtic Name: 2-[7-chloranyl-3-(2-methoxy-5-methyl-phenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(2S)-2-cyano-3-methyl-butan-2-yl]ethanamide Openeye Name: 2-[7-chloro-3-(2-methoxy-5-methyl-phenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-[(1S)-1-cyano-1,2-dimethyl-propyl]acetamide CAS Name: 2-[[7-chloro-3-(2-methoxy-5-methylphenyl)-4-oxo-2-quinazolinyl]thio]-N-[(2S)-2-cyano-3-methylbutan-2-yl]acetamide IUPAC Name: 2-[7-chloro-3-(2-methoxy-5-methylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-[(2S)-2-cyano-3-methylbutan-2-yl]acetamide Traditional Name: 2-[[7-chloro-4-keto-3-(2-methoxy-5-methyl-phenyl)quinazolin-2-yl]thio]-N-[(1S)-1-cyano-1,2-dimethyl-propyl]acetamide Formula: C24H25ClN4O3S MolecularWeight: 484.9983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC(=O)NC(C)(C#N)C(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC(=O)N[C@](C)(C#N)C(C)C

InChI

InChI=1S/C24H25ClN4O3S/c1-14(2)24(4,13-26)28-21(30)12-33-23-27-18-11-16(25)7-8-17(18)22(31)29(23)19-10-15(3)6-9-20(19)32-5/h6-11,14H,12H2,1-5H3,(H,28,30)/t24-/m1/s1