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

Systemtic Name: methyl 2-[[6-tert-butyl-2-[2-(3-chloranylphenoxy)propanoylamino]-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]carbonylamino]benzoate Openeye Name: methyl 2-[[6-tert-butyl-2-[2-(3-chlorophenoxy)propanoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carbonyl]amino]benzoate CAS Name: 2-[[[6-tert-butyl-2-[[2-(3-chlorophenoxy)-1-oxopropyl]amino]-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[6-tert-butyl-2-[2-(3-chlorophenoxy)propanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl]amino]benzoate Traditional Name: 2-[[6-tert-butyl-2-[2-(3-chlorophenoxy)propanoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carbonyl]amino]benzoic acid methyl ester Formula: C30H33ClN2O5S MolecularWeight: 569.11142

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C2=C(S1)CC(CC2)C(C)(C)C)C(=O)NC3=CC=CC=C3C(=O)OC)OC4=CC(=CC=C4)Cl

Isomeric SMILES

CC(C(=O)NC1=C(C2=C(S1)CC(CC2)C(C)(C)C)C(=O)NC3=CC=CC=C3C(=O)OC)OC4=CC(=CC=C4)Cl

InChI

InChI=1S/C30H33ClN2O5S/c1-17(38-20-10-8-9-19(31)16-20)26(34)33-28-25(22-14-13-18(30(2,3)4)15-24(22)39-28)27(35)32-23-12-7-6-11-21(23)29(36)37-5/h6-12,16-18H,13-15H2,1-5H3,(H,32,35)(H,33,34)