ethyl 5-[2-[2,4-bis(oxidanylidene)pyrimidin-1-yl]ethanoylamino]-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 5-[2-[2,4-bis(oxidanylidene)pyrimidin-1-yl]ethanoylamino]-1-benzothiophene-2-carboxylate Openeye Name: ethyl 5-[[2-(2,4-dioxopyrimidin-1-yl)acetyl]amino]benzothiophene-2-carboxylate CAS Name: 5-[[2-(2,4-dioxo-1-pyrimidinyl)-1-oxoethyl]amino]-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[[2-(2,4-dioxopyrimidin-1-yl)acetyl]amino]-1-benzothiophene-2-carboxylate Traditional Name: 5-[[2-(2,4-diketopyrimidin-1-yl)acetyl]amino]benzothiophene-2-carboxylic acid ethyl ester Formula: C17H15N3O5S MolecularWeight: 373.3831

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(S1)C=CC(=C2)NC(=O)CN3C=CC(=O)NC3=O

Isomeric SMILES

CCOC(=O)C1=CC2=C(S1)C=CC(=C2)NC(=O)CN3C=CC(=O)NC3=O

InChI

InChI=1S/C17H15N3O5S/c1-2-25-16(23)13-8-10-7-11(3-4-12(10)26-13)18-15(22)9-20-6-5-14(21)19-17(20)24/h3-8H,2,9H2,1H3,(H,18,22)(H,19,21,24)