N-[3-methyl-1-oxidanylidene-1-(propylamino)butan-2-yl]-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[3-methyl-1-oxidanylidene-1-(propylamino)butan-2-yl]-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-methyl-1-(propylcarbamoyl)propyl]-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: N-[3-methyl-1-oxo-1-(propylamino)butan-2-yl]-1-(4-methylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[3-methyl-1-oxo-1-(propylamino)butan-2-yl]-1-(4-methylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[2-methyl-1-(propylcarbamoyl)propyl]-1-tosyl-isonipecotamide Formula: C21H33N3O4S MolecularWeight: 423.56942

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C(C)C)NC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCNC(=O)C(C(C)C)NC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C21H33N3O4S/c1-5-12-22-21(26)19(15(2)3)23-20(25)17-10-13-24(14-11-17)29(27,28)18-8-6-16(4)7-9-18/h6-9,15,17,19H,5,10-14H2,1-4H3,(H,22,26)(H,23,25)