methyl 2-[[6-tert-butyl-2-(furan-2-ylcarbonylamino)-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]carbonylamino]benzoate

Systemtic Name: methyl 2-[[6-tert-butyl-2-(furan-2-ylcarbonylamino)-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]carbonylamino]benzoate Openeye Name: methyl 2-[[6-tert-butyl-2-(furan-2-carbonylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carbonyl]amino]benzoate CAS Name: 2-[[[6-tert-butyl-2-[[2-furanyl(oxo)methyl]amino]-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[6-tert-butyl-2-(furan-2-carbonylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl]amino]benzoate Traditional Name: 2-[[6-tert-butyl-2-(2-furoylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carbonyl]amino]benzoic acid methyl ester Formula: C26H28N2O5S MolecularWeight: 480.57592

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)NC3=CC=CC=C3C(=O)OC)NC(=O)C4=CC=CO4

Isomeric SMILES

CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)NC3=CC=CC=C3C(=O)OC)NC(=O)C4=CC=CO4

InChI

InChI=1S/C26H28N2O5S/c1-26(2,3)15-11-12-17-20(14-15)34-24(28-22(29)19-10-7-13-33-19)21(17)23(30)27-18-9-6-5-8-16(18)25(31)32-4/h5-10,13,15H,11-12,14H2,1-4H3,(H,27,30)(H,28,29)