N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-1-methyl-pyrazole-4-sulfonamide

Systemtic Name: N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-1-methyl-pyrazole-4-sulfonamide Openeye Name: N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-1-methyl-pyrazole-4-sulfonamide CAS Name: N-[4-ethoxy-3-(1-pyrrolidinylsulfonyl)phenyl]-1-methyl-4-pyrazolesulfonamide IUPAC Name: N-(4-ethoxy-3-pyrrolidin-1-ylsulfonylphenyl)-1-methylpyrazole-4-sulfonamide Traditional Name: N-(4-ethoxy-3-pyrrolidinosulfonyl-phenyl)-1-methyl-pyrazole-4-sulfonamide Formula: C16H22N4O5S2 MolecularWeight: 414.49968

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NS(=O)(=O)C2=CN(N=C2)C)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)NS(=O)(=O)C2=CN(N=C2)C)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C16H22N4O5S2/c1-3-25-15-7-6-13(18-26(21,22)14-11-17-19(2)12-14)10-16(15)27(23,24)20-8-4-5-9-20/h6-7,10-12,18H,3-5,8-9H2,1-2H3