ethyl 2-[2-(6-bromanyl-2-oxidanylidene-1,3-benzoxazol-3-yl)ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(6-bromanyl-2-oxidanylidene-1,3-benzoxazol-3-yl)ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(6-bromo-2-oxo-1,3-benzoxazol-3-yl)acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[2-(6-bromo-2-oxo-1,3-benzoxazol-3-yl)-1-oxoethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(6-bromo-2-oxo-1,3-benzoxazol-3-yl)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[[2-(6-bromo-2-keto-1,3-benzoxazol-3-yl)acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C20H19BrN2O5S MolecularWeight: 479.34426

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CN3C4=C(C=C(C=C4)Br)OC3=O

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CN3C4=C(C=C(C=C4)Br)OC3=O

InChI

InChI=1S/C20H19BrN2O5S/c1-2-27-19(25)17-12-5-3-4-6-15(12)29-18(17)22-16(24)10-23-13-8-7-11(21)9-14(13)28-20(23)26/h7-9H,2-6,10H2,1H3,(H,22,24)