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

Systemtic Name: N-[4-(4-ethylpiperazin-1-yl)-3-methyl-phenyl]-1-methylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[4-(4-ethylpiperazin-1-yl)-3-methyl-phenyl]-1-methylsulfonyl-piperidine-4-carboxamide CAS Name: N-[4-(4-ethyl-1-piperazinyl)-3-methylphenyl]-1-methylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[4-(4-ethylpiperazin-1-yl)-3-methylphenyl]-1-methylsulfonylpiperidine-4-carboxamide Traditional Name: N-[4-(4-ethylpiperazino)-3-methyl-phenyl]-1-mesyl-isonipecotamide Formula: C20H32N4O3S MolecularWeight: 408.55808

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C)C

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C)C

InChI

InChI=1S/C20H32N4O3S/c1-4-22-11-13-23(14-12-22)19-6-5-18(15-16(19)2)21-20(25)17-7-9-24(10-8-17)28(3,26)27/h5-6,15,17H,4,7-14H2,1-3H3,(H,21,25)