N-(4-ethoxy-3-piperidin-1-ylsulfonyl-phenyl)-3-(1,3,5-trimethylpyrazol-4-yl)propanamide

Systemtic Name: N-(4-ethoxy-3-piperidin-1-ylsulfonyl-phenyl)-3-(1,3,5-trimethylpyrazol-4-yl)propanamide Openeye Name: N-[4-ethoxy-3-(1-piperidylsulfonyl)phenyl]-3-(1,3,5-trimethylpyrazol-4-yl)propanamide CAS Name: N-[4-ethoxy-3-(1-piperidinylsulfonyl)phenyl]-3-(1,3,5-trimethyl-4-pyrazolyl)propanamide IUPAC Name: N-(4-ethoxy-3-piperidin-1-ylsulfonylphenyl)-3-(1,3,5-trimethylpyrazol-4-yl)propanamide Traditional Name: N-(4-ethoxy-3-piperidinosulfonyl-phenyl)-3-(1,3,5-trimethylpyrazol-4-yl)propionamide Formula: C22H32N4O4S MolecularWeight: 448.57888

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)CCC2=C(N(N=C2C)C)C)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)CCC2=C(N(N=C2C)C)C)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C22H32N4O4S/c1-5-30-20-11-9-18(15-21(20)31(28,29)26-13-7-6-8-14-26)23-22(27)12-10-19-16(2)24-25(4)17(19)3/h9,11,15H,5-8,10,12-14H2,1-4H3,(H,23,27)