methyl 4-methyl-3-[2-(4-oxidanylidene-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-3-yl)ethanoylamino]benzoate

Systemtic Name: methyl 4-methyl-3-[2-(4-oxidanylidene-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-3-yl)ethanoylamino]benzoate Openeye Name: methyl 4-methyl-3-[[2-[4-oxo-5-(2-thienyl)thieno[2,3-d]pyrimidin-3-yl]acetyl]amino]benzoate CAS Name: 4-methyl-3-[[1-oxo-2-(4-oxo-5-thiophen-2-yl-3-thieno[2,3-d]pyrimidinyl)ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[[2-(4-oxo-5-thiophen-2-ylthieno[2,3-d]pyrimidin-3-yl)acetyl]amino]benzoate Traditional Name: 3-[[2-[4-keto-5-(2-thienyl)thieno[2,3-d]pyrimidin-3-yl]acetyl]amino]-4-methyl-benzoic acid methyl ester Formula: C21H17N3O4S2 MolecularWeight: 439.50738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CN2C=NC3=C(C2=O)C(=CS3)C4=CC=CS4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CN2C=NC3=C(C2=O)C(=CS3)C4=CC=CS4

InChI

InChI=1S/C21H17N3O4S2/c1-12-5-6-13(21(27)28-2)8-15(12)23-17(25)9-24-11-22-19-18(20(24)26)14(10-30-19)16-4-3-7-29-16/h3-8,10-11H,9H2,1-2H3,(H,23,25)