N-[5-chloranyl-4-[2-(4-dimethylaminophenyl)sulfonylpropanoylamino]-2-oxidanyl-phenyl]thiophene-2-carboxamide

Systemtic Name: N-[5-chloranyl-4-[2-(4-dimethylaminophenyl)sulfonylpropanoylamino]-2-oxidanyl-phenyl]thiophene-2-carboxamide Openeye Name: N-[5-chloro-4-[2-(4-dimethylaminophenyl)sulfonylpropanoylamino]-2-hydroxy-phenyl]thiophene-2-carboxamide CAS Name: N-[5-chloro-4-[[2-(4-dimethylaminophenyl)sulfonyl-1-oxopropyl]amino]-2-hydroxyphenyl]-2-thiophenecarboxamide IUPAC Name: N-[5-chloro-4-[2-(4-dimethylaminophenyl)sulfonylpropanoylamino]-2-hydroxyphenyl]thiophene-2-carboxamide Traditional Name: N-[5-chloro-4-[2-(4-dimethylaminophenyl)sulfonylpropanoylamino]-2-hydroxy-phenyl]thiophene-2-carboxamide Formula: C22H22ClN3O5S2 MolecularWeight: 508.01018

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=C(C=C1Cl)NC(=O)C2=CC=CS2)O)S(=O)(=O)C3=CC=C(C=C3)N(C)C

Isomeric SMILES

CC(C(=O)NC1=CC(=C(C=C1Cl)NC(=O)C2=CC=CS2)O)S(=O)(=O)C3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C22H22ClN3O5S2/c1-13(33(30,31)15-8-6-14(7-9-15)26(2)3)21(28)24-17-12-19(27)18(11-16(17)23)25-22(29)20-5-4-10-32-20/h4-13,27H,1-3H3,(H,24,28)(H,25,29)