(2R)-2-[6-chloranyl-3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-cyanoethyl)-N-methyl-propanamide

Systemtic Name: (2R)-2-[6-chloranyl-3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-cyanoethyl)-N-methyl-propanamide Openeye Name: (2R)-2-(6-chloro-3-isobutyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(2-cyanoethyl)-N-methyl-propanamide CAS Name: (2R)-2-[[6-chloro-3-(2-methylpropyl)-4-oxo-2-quinazolinyl]thio]-N-(2-cyanoethyl)-N-methylpropanamide IUPAC Name: (2R)-2-[6-chloro-3-(2-methylpropyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(2-cyanoethyl)-N-methylpropanamide Traditional Name: (2R)-2-[(6-chloro-3-isobutyl-4-keto-quinazolin-2-yl)thio]-N-(2-cyanoethyl)-N-methyl-propionamide Formula: C19H23ClN4O2S MolecularWeight: 406.92952

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C=CC(=C2)Cl)N=C1SC(C)C(=O)N(C)CCC#N

Isomeric SMILES

C[C@H](C(=O)N(C)CCC#N)SC1=NC2=C(C=C(C=C2)Cl)C(=O)N1CC(C)C

InChI

InChI=1S/C19H23ClN4O2S/c1-12(2)11-24-18(26)15-10-14(20)6-7-16(15)22-19(24)27-13(3)17(25)23(4)9-5-8-21/h6-7,10,12-13H,5,9,11H2,1-4H3/t13-/m1/s1