2-(4-oxidanylidene-6-phenyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(propan-2-ylcarbamoyl)ethanamide

Systemtic Name: 2-(4-oxidanylidene-6-phenyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(propan-2-ylcarbamoyl)ethanamide Openeye Name: 2-(3-allyl-4-oxo-6-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(isopropylcarbamoyl)acetamide CAS Name: 2-[(4-oxo-6-phenyl-3-prop-2-enyl-2-thieno[2,3-d]pyrimidinyl)thio]-N-[oxo-(propan-2-ylamino)methyl]acetamide IUPAC Name: 2-(4-oxo-6-phenyl-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(propan-2-ylcarbamoyl)acetamide Traditional Name: 2-[(3-allyl-4-keto-6-phenyl-thieno[2,3-d]pyrimidin-2-yl)thio]-N-(isopropylcarbamoyl)acetamide Formula: C21H22N4O3S2 MolecularWeight: 442.55438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC(=O)CSC1=NC2=C(C=C(S2)C3=CC=CC=C3)C(=O)N1CC=C

Isomeric SMILES

CC(C)NC(=O)NC(=O)CSC1=NC2=C(C=C(S2)C3=CC=CC=C3)C(=O)N1CC=C

InChI

InChI=1S/C21H22N4O3S2/c1-4-10-25-19(27)15-11-16(14-8-6-5-7-9-14)30-18(15)24-21(25)29-12-17(26)23-20(28)22-13(2)3/h4-9,11,13H,1,10,12H2,2-3H3,(H2,22,23,26,28)