3-[(3,4-dimethylphenyl)sulfonylamino]-N-[(2S)-2-(furan-2-yl)-2-piperidin-1-yl-ethyl]propanamide

Systemtic Name: 3-[(3,4-dimethylphenyl)sulfonylamino]-N-[(2S)-2-(furan-2-yl)-2-piperidin-1-yl-ethyl]propanamide Openeye Name: 3-[(3,4-dimethylphenyl)sulfonylamino]-N-[(2S)-2-(2-furyl)-2-(1-piperidyl)ethyl]propanamide CAS Name: 3-[(3,4-dimethylphenyl)sulfonylamino]-N-[(2S)-2-(2-furanyl)-2-(1-piperidinyl)ethyl]propanamide IUPAC Name: 3-[(3,4-dimethylphenyl)sulfonylamino]-N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ylethyl]propanamide Traditional Name: 3-[(3,4-dimethylphenyl)sulfonylamino]-N-[(2S)-2-(2-furyl)-2-piperidino-ethyl]propionamide Formula: C22H31N3O4S MolecularWeight: 433.56424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCCC(=O)NCC(C2=CC=CO2)N3CCCCC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCCC(=O)NC[C@@H](C2=CC=CO2)N3CCCCC3)C

InChI

InChI=1S/C22H31N3O4S/c1-17-8-9-19(15-18(17)2)30(27,28)24-11-10-22(26)23-16-20(21-7-6-14-29-21)25-12-4-3-5-13-25/h6-9,14-15,20,24H,3-5,10-13,16H2,1-2H3,(H,23,26)/t20-/m0/s1