1-[4-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]phenyl]sulfonylpiperidine-4-carboxamide

Systemtic Name: 1-[4-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]phenyl]sulfonylpiperidine-4-carboxamide Openeye Name: 1-[4-[(3-chlorobenzothiophene-2-carbonyl)amino]phenyl]sulfonylpiperidine-4-carboxamide CAS Name: 1-[4-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]amino]phenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: 1-[4-[(3-chloro-1-benzothiophene-2-carbonyl)amino]phenyl]sulfonylpiperidine-4-carboxamide Traditional Name: 1-[4-[(3-chlorobenzothiophene-2-carbonyl)amino]phenyl]sulfonylisonipecotamide Formula: C21H20ClN3O4S2 MolecularWeight: 477.9842

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

C1CN(CCC1C(=O)N)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C21H20ClN3O4S2/c22-18-16-3-1-2-4-17(16)30-19(18)21(27)24-14-5-7-15(8-6-14)31(28,29)25-11-9-13(10-12-25)20(23)26/h1-8,13H,9-12H2,(H2,23,26)(H,24,27)