N-[2-(4-ethylpiperazin-1-yl)phenyl]-1-methylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[2-(4-ethylpiperazin-1-yl)phenyl]-1-methylsulfonyl-piperidine-3-carboxamide Openeye Name: N-[2-(4-ethylpiperazin-1-yl)phenyl]-1-methylsulfonyl-piperidine-3-carboxamide CAS Name: N-[2-(4-ethyl-1-piperazinyl)phenyl]-1-methylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-[2-(4-ethylpiperazin-1-yl)phenyl]-1-methylsulfonylpiperidine-3-carboxamide Traditional Name: N-[2-(4-ethylpiperazino)phenyl]-1-mesyl-nipecotamide Formula: C19H30N4O3S MolecularWeight: 394.5315

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC=CC=C2NC(=O)C3CCCN(C3)S(=O)(=O)C

Isomeric SMILES

CCN1CCN(CC1)C2=CC=CC=C2NC(=O)C3CCCN(C3)S(=O)(=O)C

InChI

InChI=1S/C19H30N4O3S/c1-3-21-11-13-22(14-12-21)18-9-5-4-8-17(18)20-19(24)16-7-6-10-23(15-16)27(2,25)26/h4-5,8-9,16H,3,6-7,10-15H2,1-2H3,(H,20,24)