(3,5-dimethyl-4-pyrrolidin-1-ylsulfonyl-pyrazol-1-yl)-(2-ethoxyphenyl)methanone

Systemtic Name: (3,5-dimethyl-4-pyrrolidin-1-ylsulfonyl-pyrazol-1-yl)-(2-ethoxyphenyl)methanone Openeye Name: (3,5-dimethyl-4-pyrrolidin-1-ylsulfonyl-pyrazol-1-yl)-(2-ethoxyphenyl)methanone CAS Name: [3,5-dimethyl-4-(1-pyrrolidinylsulfonyl)-1-pyrazolyl]-(2-ethoxyphenyl)methanone IUPAC Name: (3,5-dimethyl-4-pyrrolidin-1-ylsulfonylpyrazol-1-yl)-(2-ethoxyphenyl)methanone Traditional Name: (3,5-dimethyl-4-pyrrolidinosulfonyl-pyrazol-1-yl)-o-phenetyl-methanone Formula: C18H23N3O4S MolecularWeight: 377.45792

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(=O)N2C(=C(C(=N2)C)S(=O)(=O)N3CCCC3)C

Isomeric SMILES

CCOC1=CC=CC=C1C(=O)N2C(=C(C(=N2)C)S(=O)(=O)N3CCCC3)C

InChI

InChI=1S/C18H23N3O4S/c1-4-25-16-10-6-5-9-15(16)18(22)21-14(3)17(13(2)19-21)26(23,24)20-11-7-8-12-20/h5-6,9-10H,4,7-8,11-12H2,1-3H3