propan-2-yl 2-[2-[(Z)-2-acetamido-3-phenyl-prop-2-enoyl]oxyethanoylamino]-6-methyl-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]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: isopropyl 2-[[2-[(Z)-2-acetamido-3-phenyl-prop-2-enoyl]oxyacetyl]amino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[2-[(Z)-2-acetamido-1-oxo-3-phenylprop-2-enoxy]-1-oxoethyl]amino]-6-methyl-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]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[[2-[(Z)-2-acetamido-3-phenyl-acryloyl]oxyacetyl]amino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid isopropyl ester Formula: C26H30N2O6S MolecularWeight: 498.5912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C(=O)OC(C)C)NC(=O)COC(=O)C(=CC3=CC=CC=C3)NC(=O)C

Isomeric SMILES

CC1CCC2=C(C1)SC(=C2C(=O)OC(C)C)NC(=O)COC(=O)/C(=C/C3=CC=CC=C3)/NC(=O)C

InChI

InChI=1S/C26H30N2O6S/c1-15(2)34-26(32)23-19-11-10-16(3)12-21(19)35-24(23)28-22(30)14-33-25(31)20(27-17(4)29)13-18-8-6-5-7-9-18/h5-9,13,15-16H,10-12,14H2,1-4H3,(H,27,29)(H,28,30)/b20-13-