2-(4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(2-phenylpropyl)propanamide

Systemtic Name: 2-(4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(2-phenylpropyl)propanamide Openeye Name: 2-(3-allyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(2-phenylpropyl)propanamide CAS Name: 2-[(4-oxo-3-prop-2-enyl-2-thieno[2,3-d]pyrimidinyl)thio]-N-(2-phenylpropyl)propanamide IUPAC Name: 2-(4-oxo-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(2-phenylpropyl)propanamide Traditional Name: 2-[(3-allyl-4-keto-thieno[2,3-d]pyrimidin-2-yl)thio]-N-(2-phenylpropyl)propionamide Formula: C21H23N3O2S2 MolecularWeight: 413.55622

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C(C)SC1=NC2=C(C=CS2)C(=O)N1CC=C)C3=CC=CC=C3

Isomeric SMILES

CC(CNC(=O)C(C)SC1=NC2=C(C=CS2)C(=O)N1CC=C)C3=CC=CC=C3

InChI

InChI=1S/C21H23N3O2S2/c1-4-11-24-20(26)17-10-12-27-19(17)23-21(24)28-15(3)18(25)22-13-14(2)16-8-6-5-7-9-16/h4-10,12,14-15H,1,11,13H2,2-3H3,(H,22,25)