3-[2-[(5,6-dimethyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]propanoylamino]-N-methyl-benzamide

Systemtic Name: 3-[2-[(5,6-dimethyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]propanoylamino]-N-methyl-benzamide Openeye Name: 3-[2-[(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]propanoylamino]-N-methyl-benzamide CAS Name: 3-[[2-[(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methylthio]-1-oxopropyl]amino]-N-methylbenzamide IUPAC Name: 3-[2-[(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]propanoylamino]-N-methylbenzamide Traditional Name: 3-[2-[(4-keto-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-2-yl)methylthio]propanoylamino]-N-methyl-benzamide Formula: C20H22N4O3S2 MolecularWeight: 430.54368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CSC(C)C(=O)NC3=CC=CC(=C3)C(=O)NC)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CSC(C)C(=O)NC3=CC=CC(=C3)C(=O)NC)C

InChI

InChI=1S/C20H22N4O3S2/c1-10-11(2)29-20-16(10)19(27)23-15(24-20)9-28-12(3)17(25)22-14-7-5-6-13(8-14)18(26)21-4/h5-8,12H,9H2,1-4H3,(H,21,26)(H,22,25)(H,23,24,27)