N-[2-(5-methyl-4-oxidanylidene-6-phenyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylethyl]ethanamide

Systemtic Name: N-[2-(5-methyl-4-oxidanylidene-6-phenyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylethyl]ethanamide Openeye Name: N-[2-(3-allyl-5-methyl-4-oxo-6-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylethyl]acetamide CAS Name: N-[2-[(5-methyl-4-oxo-6-phenyl-3-prop-2-enyl-2-thieno[2,3-d]pyrimidinyl)thio]ethyl]acetamide IUPAC Name: N-[2-(5-methyl-4-oxo-6-phenyl-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl)sulfanylethyl]acetamide Traditional Name: N-[2-[(3-allyl-4-keto-5-methyl-6-phenyl-thieno[2,3-d]pyrimidin-2-yl)thio]ethyl]acetamide Formula: C20H21N3O2S2 MolecularWeight: 399.52964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)SCCNC(=O)C)CC=C)C3=CC=CC=C3

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)SCCNC(=O)C)CC=C)C3=CC=CC=C3

InChI

InChI=1S/C20H21N3O2S2/c1-4-11-23-19(25)16-13(2)17(15-8-6-5-7-9-15)27-18(16)22-20(23)26-12-10-21-14(3)24/h4-9H,1,10-12H2,2-3H3,(H,21,24)