methyl 6-[[5-[(4-butan-2-ylphenoxy)methyl]furan-2-yl]carbonylamino]-3-chloranyl-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 6-[[5-[(4-butan-2-ylphenoxy)methyl]furan-2-yl]carbonylamino]-3-chloranyl-1-benzothiophene-2-carboxylate Openeye Name: methyl 3-chloro-6-[[5-[(4-sec-butylphenoxy)methyl]furan-2-carbonyl]amino]benzothiophene-2-carboxylate CAS Name: 6-[[[5-[(4-butan-2-ylphenoxy)methyl]-2-furanyl]-oxomethyl]amino]-3-chloro-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 6-[[5-[(4-butan-2-ylphenoxy)methyl]furan-2-carbonyl]amino]-3-chloro-1-benzothiophene-2-carboxylate Traditional Name: 3-chloro-6-[[5-[(4-sec-butylphenoxy)methyl]-2-furoyl]amino]benzothiophene-2-carboxylic acid methyl ester Formula: C26H24ClNO5S MolecularWeight: 497.99046

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)OCC2=CC=C(O2)C(=O)NC3=CC4=C(C=C3)C(=C(S4)C(=O)OC)Cl

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)OCC2=CC=C(O2)C(=O)NC3=CC4=C(C=C3)C(=C(S4)C(=O)OC)Cl

InChI

InChI=1S/C26H24ClNO5S/c1-4-15(2)16-5-8-18(9-6-16)32-14-19-10-12-21(33-19)25(29)28-17-7-11-20-22(13-17)34-24(23(20)27)26(30)31-3/h5-13,15H,4,14H2,1-3H3,(H,28,29)