(2S)-N-ethyl-2-(5-methyl-4-oxidanylidene-6-phenyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-propanamide

Systemtic Name: (2S)-N-ethyl-2-(5-methyl-4-oxidanylidene-6-phenyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-propanamide Openeye Name: (2S)-2-(3-allyl-5-methyl-4-oxo-6-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-ethyl-propanamide CAS Name: (2S)-N-ethyl-2-[(5-methyl-4-oxo-6-phenyl-3-prop-2-enyl-2-thieno[2,3-d]pyrimidinyl)thio]propanamide IUPAC Name: (2S)-N-ethyl-2-(5-methyl-4-oxo-6-phenyl-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl)sulfanylpropanamide Traditional Name: (2S)-2-[(3-allyl-4-keto-5-methyl-6-phenyl-thieno[2,3-d]pyrimidin-2-yl)thio]-N-ethyl-propionamide Formula: C21H23N3O2S2 MolecularWeight: 413.55622

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)SC1=NC2=C(C(=C(S2)C3=CC=CC=C3)C)C(=O)N1CC=C

Isomeric SMILES

CCNC(=O)[C@H](C)SC1=NC2=C(C(=C(S2)C3=CC=CC=C3)C)C(=O)N1CC=C

InChI

InChI=1S/C21H23N3O2S2/c1-5-12-24-20(26)16-13(3)17(15-10-8-7-9-11-15)28-19(16)23-21(24)27-14(4)18(25)22-6-2/h5,7-11,14H,1,6,12H2,2-4H3,(H,22,25)/t14-/m0/s1