propan-2-yl 2-[2-[(Z)-2-acetamido-3-phenyl-prop-2-enoyl]oxyethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: propan-2-yl 2-[2-[(Z)-2-acetamido-3-phenyl-prop-2-enoyl]oxyethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: isopropyl 2-[[2-[(Z)-2-acetamido-3-phenyl-prop-2-enoyl]oxyacetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[2-[(Z)-2-acetamido-1-oxo-3-phenylprop-2-enoxy]-1-oxoethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[[2-[(Z)-2-acetamido-3-phenylprop-2-enoyl]oxyacetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[[2-[(Z)-2-acetamido-3-phenyl-acryloyl]oxyacetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid isopropyl ester Formula: C25H28N2O6S MolecularWeight: 484.56462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=C(SC2=C1CCCC2)NC(=O)COC(=O)C(=CC3=CC=CC=C3)NC(=O)C

Isomeric SMILES

CC(C)OC(=O)C1=C(SC2=C1CCCC2)NC(=O)COC(=O)/C(=C/C3=CC=CC=C3)/NC(=O)C

InChI

InChI=1S/C25H28N2O6S/c1-15(2)33-25(31)22-18-11-7-8-12-20(18)34-23(22)27-21(29)14-32-24(30)19(26-16(3)28)13-17-9-5-4-6-10-17/h4-6,9-10,13,15H,7-8,11-12,14H2,1-3H3,(H,26,28)(H,27,29)/b19-13-