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

Systemtic Name: (2R)-2-[6-chloranyl-3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-prop-2-enyl-propanamide Openeye Name: (2R)-N-allyl-2-(6-chloro-3-isobutyl-4-oxo-quinazolin-2-yl)sulfanyl-propanamide CAS Name: (2R)-2-[[6-chloro-3-(2-methylpropyl)-4-oxo-2-quinazolinyl]thio]-N-prop-2-enylpropanamide IUPAC Name: (2R)-2-[6-chloro-3-(2-methylpropyl)-4-oxoquinazolin-2-yl]sulfanyl-N-prop-2-enylpropanamide Traditional Name: (2R)-N-allyl-2-[(6-chloro-3-isobutyl-4-keto-quinazolin-2-yl)thio]propionamide Formula: C18H22ClN3O2S MolecularWeight: 379.90418

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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)NCC=C

Isomeric SMILES

C[C@H](C(=O)NCC=C)SC1=NC2=C(C=C(C=C2)Cl)C(=O)N1CC(C)C

InChI

InChI=1S/C18H22ClN3O2S/c1-5-8-20-16(23)12(4)25-18-21-15-7-6-13(19)9-14(15)17(24)22(18)10-11(2)3/h5-7,9,11-12H,1,8,10H2,2-4H3,(H,20,23)/t12-/m1/s1