N-[1-(4-ethylphenyl)-2-methyl-propyl]-1-(1-methylpyrrol-3-yl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[1-(4-ethylphenyl)-2-methyl-propyl]-1-(1-methylpyrrol-3-yl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[1-(4-ethylphenyl)-2-methyl-propyl]-1-(1-methylpyrrol-3-yl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[1-(4-ethylphenyl)-2-methylpropyl]-1-[(1-methyl-3-pyrrolyl)sulfonyl]-4-piperidinecarboxamide IUPAC Name: N-[1-(4-ethylphenyl)-2-methylpropyl]-1-(1-methylpyrrol-3-yl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[1-(4-ethylphenyl)-2-methyl-propyl]-1-(1-methylpyrrol-3-yl)sulfonyl-isonipecotamide Formula: C23H33N3O3S MolecularWeight: 431.59142

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C(C)C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CN(C=C3)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(C(C)C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CN(C=C3)C

InChI

InChI=1S/C23H33N3O3S/c1-5-18-6-8-19(9-7-18)22(17(2)3)24-23(27)20-10-14-26(15-11-20)30(28,29)21-12-13-25(4)16-21/h6-9,12-13,16-17,20,22H,5,10-11,14-15H2,1-4H3,(H,24,27)