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

Systemtic Name: methyl 3-chloranyl-6-[[5-[(4-propylphenoxy)methyl]furan-2-yl]carbonylamino]-1-benzothiophene-2-carboxylate Openeye Name: methyl 3-chloro-6-[[5-[(4-propylphenoxy)methyl]furan-2-carbonyl]amino]benzothiophene-2-carboxylate CAS Name: 3-chloro-6-[[oxo-[5-[(4-propylphenoxy)methyl]-2-furanyl]methyl]amino]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 3-chloro-6-[[5-[(4-propylphenoxy)methyl]furan-2-carbonyl]amino]-1-benzothiophene-2-carboxylate Traditional Name: 3-chloro-6-[[5-[(4-propylphenoxy)methyl]-2-furoyl]amino]benzothiophene-2-carboxylic acid methyl ester Formula: C25H22ClNO5S MolecularWeight: 483.96388

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)OCC2=CC=C(O2)C(=O)NC3=CC4=C(C=C3)C(=C(S4)C(=O)OC)Cl

Isomeric SMILES

CCCC1=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/C25H22ClNO5S/c1-3-4-15-5-8-17(9-6-15)31-14-18-10-12-20(32-18)24(28)27-16-7-11-19-21(13-16)33-23(22(19)26)25(29)30-2/h5-13H,3-4,14H2,1-2H3,(H,27,28)