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

Systemtic Name: N-(4-acetamidophenyl)-2-(6-ethyl-4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-propanamide Openeye Name: N-(4-acetamidophenyl)-2-(3-allyl-6-ethyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-propanamide CAS Name: N-(4-acetamidophenyl)-2-[(6-ethyl-4-oxo-3-prop-2-enyl-2-thieno[2,3-d]pyrimidinyl)thio]propanamide IUPAC Name: N-(4-acetamidophenyl)-2-(6-ethyl-4-oxo-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl)sulfanylpropanamide Traditional Name: N-(4-acetamidophenyl)-2-[(3-allyl-6-ethyl-4-keto-thieno[2,3-d]pyrimidin-2-yl)thio]propionamide Formula: C22H24N4O3S2 MolecularWeight: 456.58096

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)N=C(N(C2=O)CC=C)SC(C)C(=O)NC3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CCC1=CC2=C(S1)N=C(N(C2=O)CC=C)SC(C)C(=O)NC3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C22H24N4O3S2/c1-5-11-26-21(29)18-12-17(6-2)31-20(18)25-22(26)30-13(3)19(28)24-16-9-7-15(8-10-16)23-14(4)27/h5,7-10,12-13H,1,6,11H2,2-4H3,(H,23,27)(H,24,28)