(2R)-N-(2-cyanophenyl)-2-[4-oxidanylidene-3-(2-propan-2-ylphenyl)quinazolin-2-yl]sulfanyl-propanamide

Systemtic Name: (2R)-N-(2-cyanophenyl)-2-[4-oxidanylidene-3-(2-propan-2-ylphenyl)quinazolin-2-yl]sulfanyl-propanamide Openeye Name: (2R)-N-(2-cyanophenyl)-2-[3-(2-isopropylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-propanamide CAS Name: (2R)-N-(2-cyanophenyl)-2-[[4-oxo-3-(2-propan-2-ylphenyl)-2-quinazolinyl]thio]propanamide IUPAC Name: (2R)-N-(2-cyanophenyl)-2-[4-oxo-3-(2-propan-2-ylphenyl)quinazolin-2-yl]sulfanylpropanamide Traditional Name: (2R)-N-(2-cyanophenyl)-2-[(4-keto-3-o-cumenyl-quinazolin-2-yl)thio]propionamide Formula: C27H24N4O2S MolecularWeight: 468.57006

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)NC4=CC=CC=C4C#N

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1C#N)SC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4C(C)C

InChI

InChI=1S/C27H24N4O2S/c1-17(2)20-11-6-9-15-24(20)31-26(33)21-12-5-8-14-23(21)30-27(31)34-18(3)25(32)29-22-13-7-4-10-19(22)16-28/h4-15,17-18H,1-3H3,(H,29,32)/t18-/m1/s1