(2R)-2-[7-chloranyl-4-oxidanylidene-3-(2-propan-2-ylphenyl)quinazolin-2-yl]sulfanylpropanenitrile

Systemtic Name: (2R)-2-[7-chloranyl-4-oxidanylidene-3-(2-propan-2-ylphenyl)quinazolin-2-yl]sulfanylpropanenitrile Openeye Name: (2R)-2-[7-chloro-3-(2-isopropylphenyl)-4-oxo-quinazolin-2-yl]sulfanylpropanenitrile CAS Name: (2R)-2-[[7-chloro-4-oxo-3-(2-propan-2-ylphenyl)-2-quinazolinyl]thio]propanenitrile IUPAC Name: (2R)-2-[7-chloro-4-oxo-3-(2-propan-2-ylphenyl)quinazolin-2-yl]sulfanylpropanenitrile Traditional Name: (2R)-2-[(7-chloro-4-keto-3-o-cumenyl-quinazolin-2-yl)thio]propionitrile Formula: C20H18ClN3OS MolecularWeight: 383.89442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SC(C)C#N

Isomeric SMILES

C[C@H](C#N)SC1=NC2=C(C=CC(=C2)Cl)C(=O)N1C3=CC=CC=C3C(C)C

InChI

InChI=1S/C20H18ClN3OS/c1-12(2)15-6-4-5-7-18(15)24-19(25)16-9-8-14(21)10-17(16)23-20(24)26-13(3)11-22/h4-10,12-13H,1-3H3/t13-/m1/s1