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

Systemtic Name: N-(3,4-diethoxyphenyl)-2-(4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: 2-(3-allyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(3,4-diethoxyphenyl)acetamide CAS Name: N-(3,4-diethoxyphenyl)-2-[(4-oxo-3-prop-2-enyl-2-thieno[2,3-d]pyrimidinyl)thio]acetamide IUPAC Name: N-(3,4-diethoxyphenyl)-2-(4-oxo-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetamide Traditional Name: 2-[(3-allyl-4-keto-thieno[2,3-d]pyrimidin-2-yl)thio]-N-(3,4-diethoxyphenyl)acetamide Formula: C21H23N3O4S2 MolecularWeight: 445.55502

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)CSC2=NC3=C(C=CS3)C(=O)N2CC=C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)CSC2=NC3=C(C=CS3)C(=O)N2CC=C)OCC

InChI

InChI=1S/C21H23N3O4S2/c1-4-10-24-20(26)15-9-11-29-19(15)23-21(24)30-13-18(25)22-14-7-8-16(27-5-2)17(12-14)28-6-3/h4,7-9,11-12H,1,5-6,10,13H2,2-3H3,(H,22,25)