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

Systemtic Name: N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-3-(1,3,5-trimethylpyrazol-4-yl)propanamide Openeye Name: N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-3-(1,3,5-trimethylpyrazol-4-yl)propanamide CAS Name: N-[4-ethoxy-3-(1-pyrrolidinylsulfonyl)phenyl]-3-(1,3,5-trimethyl-4-pyrazolyl)propanamide IUPAC Name: N-(4-ethoxy-3-pyrrolidin-1-ylsulfonylphenyl)-3-(1,3,5-trimethylpyrazol-4-yl)propanamide Traditional Name: N-(4-ethoxy-3-pyrrolidinosulfonyl-phenyl)-3-(1,3,5-trimethylpyrazol-4-yl)propionamide Formula: C21H30N4O4S MolecularWeight: 434.5523

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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)N3CCCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)CCC2=C(N(N=C2C)C)C)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C21H30N4O4S/c1-5-29-19-10-8-17(14-20(19)30(27,28)25-12-6-7-13-25)22-21(26)11-9-18-15(2)23-24(4)16(18)3/h8,10,14H,5-7,9,11-13H2,1-4H3,(H,22,26)