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

Systemtic Name: (2R)-2-[4-oxidanylidene-3-(3-phenylpropyl)quinazolin-2-yl]sulfanyl-N-prop-2-enyl-propanamide Openeye Name: (2R)-N-allyl-2-[4-oxo-3-(3-phenylpropyl)quinazolin-2-yl]sulfanyl-propanamide CAS Name: (2R)-2-[[4-oxo-3-(3-phenylpropyl)-2-quinazolinyl]thio]-N-prop-2-enylpropanamide IUPAC Name: (2R)-2-[4-oxo-3-(3-phenylpropyl)quinazolin-2-yl]sulfanyl-N-prop-2-enylpropanamide Traditional Name: (2R)-N-allyl-2-[[4-keto-3-(3-phenylpropyl)quinazolin-2-yl]thio]propionamide Formula: C23H25N3O2S MolecularWeight: 407.5285

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC=C)SC1=NC2=CC=CC=C2C(=O)N1CCCC3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)NCC=C)SC1=NC2=CC=CC=C2C(=O)N1CCCC3=CC=CC=C3

InChI

InChI=1S/C23H25N3O2S/c1-3-15-24-21(27)17(2)29-23-25-20-14-8-7-13-19(20)22(28)26(23)16-9-12-18-10-5-4-6-11-18/h3-8,10-11,13-14,17H,1,9,12,15-16H2,2H3,(H,24,27)/t17-/m1/s1