N-(2-cyanoethyl)-2-[3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-phenyl-propanamide

Systemtic Name: N-(2-cyanoethyl)-2-[3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-phenyl-propanamide Openeye Name: N-(2-cyanoethyl)-2-(3-isobutyl-4-oxo-quinazolin-2-yl)sulfanyl-N-phenyl-propanamide CAS Name: N-(2-cyanoethyl)-2-[[3-(2-methylpropyl)-4-oxo-2-quinazolinyl]thio]-N-phenylpropanamide IUPAC Name: N-(2-cyanoethyl)-2-[3-(2-methylpropyl)-4-oxoquinazolin-2-yl]sulfanyl-N-phenylpropanamide Traditional Name: N-(2-cyanoethyl)-2-[(3-isobutyl-4-keto-quinazolin-2-yl)thio]-N-phenyl-propionamide Formula: C24H26N4O2S MolecularWeight: 434.55384

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)N(CCC#N)C3=CC=CC=C3

Isomeric SMILES

CC(C)CN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)N(CCC#N)C3=CC=CC=C3

InChI

InChI=1S/C24H26N4O2S/c1-17(2)16-28-23(30)20-12-7-8-13-21(20)26-24(28)31-18(3)22(29)27(15-9-14-25)19-10-5-4-6-11-19/h4-8,10-13,17-18H,9,15-16H2,1-3H3