[5-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-2-oxidanyl-4-(phenylcarbamoyl)phenyl] 2,2-dimethylpropanoate

Systemtic Name: [5-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-2-oxidanyl-4-(phenylcarbamoyl)phenyl] 2,2-dimethylpropanoate Openeye Name: [5-[(3-chlorobenzothiophene-2-carbonyl)amino]-2-hydroxy-4-(phenylcarbamoyl)phenyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [4-[anilino(oxo)methyl]-5-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]amino]-2-hydroxyphenyl] ester IUPAC Name: [5-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-2-hydroxy-4-(phenylcarbamoyl)phenyl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [5-[(3-chlorobenzothiophene-2-carbonyl)amino]-2-hydroxy-4-(phenylcarbamoyl)phenyl] ester Formula: C27H23ClN2O5S MolecularWeight: 522.99992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OC1=C(C=C(C(=C1)NC(=O)C2=C(C3=CC=CC=C3S2)Cl)C(=O)NC4=CC=CC=C4)O

Isomeric SMILES

CC(C)(C)C(=O)OC1=C(C=C(C(=C1)NC(=O)C2=C(C3=CC=CC=C3S2)Cl)C(=O)NC4=CC=CC=C4)O

InChI

InChI=1S/C27H23ClN2O5S/c1-27(2,3)26(34)35-20-14-18(17(13-19(20)31)24(32)29-15-9-5-4-6-10-15)30-25(33)23-22(28)16-11-7-8-12-21(16)36-23/h4-14,31H,1-3H3,(H,29,32)(H,30,33)