N-[3-[(3,4-dimethoxyphenyl)amino]-3-oxidanylidene-propyl]-1-(4-fluorophenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[3-[(3,4-dimethoxyphenyl)amino]-3-oxidanylidene-propyl]-1-(4-fluorophenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[3-(3,4-dimethoxyanilino)-3-oxo-propyl]-1-(4-fluorophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[3-(3,4-dimethoxyanilino)-3-oxopropyl]-1-(4-fluorophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[3-(3,4-dimethoxyanilino)-3-oxopropyl]-1-(4-fluorophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[3-(3,4-dimethoxyanilino)-3-keto-propyl]-1-(4-fluorophenyl)sulfonyl-isonipecotamide Formula: C23H28FN3O6S MolecularWeight: 493.548323

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CCNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CCNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F)OC

InChI

InChI=1S/C23H28FN3O6S/c1-32-20-8-5-18(15-21(20)33-2)26-22(28)9-12-25-23(29)16-10-13-27(14-11-16)34(30,31)19-6-3-17(24)4-7-19/h3-8,15-16H,9-14H2,1-2H3,(H,25,29)(H,26,28)