N-[4-(4-ethylpiperazin-1-yl)sulfonylphenyl]-1-methylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[4-(4-ethylpiperazin-1-yl)sulfonylphenyl]-1-methylsulfonyl-piperidine-3-carboxamide Openeye Name: N-[4-(4-ethylpiperazin-1-yl)sulfonylphenyl]-1-methylsulfonyl-piperidine-3-carboxamide CAS Name: N-[4-[(4-ethyl-1-piperazinyl)sulfonyl]phenyl]-1-methylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-[4-(4-ethylpiperazin-1-yl)sulfonylphenyl]-1-methylsulfonylpiperidine-3-carboxamide Traditional Name: N-[4-(4-ethylpiperazino)sulfonylphenyl]-1-mesyl-nipecotamide Formula: C19H30N4O5S2 MolecularWeight: 458.5953

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3CCCN(C3)S(=O)(=O)C

Isomeric SMILES

CCN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3CCCN(C3)S(=O)(=O)C

InChI

InChI=1S/C19H30N4O5S2/c1-3-21-11-13-22(14-12-21)30(27,28)18-8-6-17(7-9-18)20-19(24)16-5-4-10-23(15-16)29(2,25)26/h6-9,16H,3-5,10-15H2,1-2H3,(H,20,24)