methyl 2-[2-(6-ethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)ethanoylamino]benzoate

Systemtic Name: methyl 2-[2-(6-ethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)ethanoylamino]benzoate Openeye Name: methyl 2-[[2-(6-ethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)acetyl]amino]benzoate CAS Name: 2-[[2-(6-ethyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-(6-ethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)acetyl]amino]benzoate Traditional Name: 2-[[2-(6-ethyl-4-keto-thieno[2,3-d]pyrimidin-3-yl)acetyl]amino]benzoic acid methyl ester Formula: C18H17N3O4S MolecularWeight: 371.41028

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)N=CN(C2=O)CC(=O)NC3=CC=CC=C3C(=O)OC

Isomeric SMILES

CCC1=CC2=C(S1)N=CN(C2=O)CC(=O)NC3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C18H17N3O4S/c1-3-11-8-13-16(26-11)19-10-21(17(13)23)9-15(22)20-14-7-5-4-6-12(14)18(24)25-2/h4-8,10H,3,9H2,1-2H3,(H,20,22)