(2R)-N-(2-cyanoethyl)-2-[3-(2,5-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-methyl-propanamide

Systemtic Name: (2R)-N-(2-cyanoethyl)-2-[3-(2,5-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-methyl-propanamide Openeye Name: (2R)-N-(2-cyanoethyl)-2-[3-(2,5-dimethylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-methyl-propanamide CAS Name: (2R)-N-(2-cyanoethyl)-2-[[3-(2,5-dimethylphenyl)-4-oxo-2-quinazolinyl]thio]-N-methylpropanamide IUPAC Name: (2R)-N-(2-cyanoethyl)-2-[3-(2,5-dimethylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-methylpropanamide Traditional Name: (2R)-N-(2-cyanoethyl)-2-[[3-(2,5-dimethylphenyl)-4-keto-quinazolin-2-yl]thio]-N-methyl-propionamide Formula: C23H24N4O2S MolecularWeight: 420.52726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)N(C)CCC#N

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C(=O)C3=CC=CC=C3N=C2S[C@H](C)C(=O)N(C)CCC#N

InChI

InChI=1S/C23H24N4O2S/c1-15-10-11-16(2)20(14-15)27-22(29)18-8-5-6-9-19(18)25-23(27)30-17(3)21(28)26(4)13-7-12-24/h5-6,8-11,14,17H,7,13H2,1-4H3/t17-/m1/s1