(2S)-2-[7-chloranyl-3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-methyl-N-phenyl-propanamide

Systemtic Name: (2S)-2-[7-chloranyl-3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-methyl-N-phenyl-propanamide Openeye Name: (2S)-2-(7-chloro-3-isobutyl-4-oxo-quinazolin-2-yl)sulfanyl-N-methyl-N-phenyl-propanamide CAS Name: (2S)-2-[[7-chloro-3-(2-methylpropyl)-4-oxo-2-quinazolinyl]thio]-N-methyl-N-phenylpropanamide IUPAC Name: (2S)-2-[7-chloro-3-(2-methylpropyl)-4-oxoquinazolin-2-yl]sulfanyl-N-methyl-N-phenylpropanamide Traditional Name: (2S)-2-[(7-chloro-3-isobutyl-4-keto-quinazolin-2-yl)thio]-N-methyl-N-phenyl-propionamide Formula: C22H24ClN3O2S MolecularWeight: 429.96286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SC(C)C(=O)N(C)C3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)N(C)C1=CC=CC=C1)SC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CC(C)C

InChI

InChI=1S/C22H24ClN3O2S/c1-14(2)13-26-21(28)18-11-10-16(23)12-19(18)24-22(26)29-15(3)20(27)25(4)17-8-6-5-7-9-17/h5-12,14-15H,13H2,1-4H3/t15-/m0/s1