methyl 4-methyl-3-[(6-pyrrolidin-1-ylpyridin-3-yl)methylsulfamoyl]benzoate

Systemtic Name: methyl 4-methyl-3-[(6-pyrrolidin-1-ylpyridin-3-yl)methylsulfamoyl]benzoate Openeye Name: methyl 4-methyl-3-[(6-pyrrolidin-1-yl-3-pyridyl)methylsulfamoyl]benzoate CAS Name: 4-methyl-3-[[6-(1-pyrrolidinyl)-3-pyridinyl]methylsulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[(6-pyrrolidin-1-ylpyridin-3-yl)methylsulfamoyl]benzoate Traditional Name: 4-methyl-3-[(6-pyrrolidino-3-pyridyl)methylsulfamoyl]benzoic acid methyl ester Formula: C19H23N3O4S MolecularWeight: 389.46862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)S(=O)(=O)NCC2=CN=C(C=C2)N3CCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)S(=O)(=O)NCC2=CN=C(C=C2)N3CCCC3

InChI

InChI=1S/C19H23N3O4S/c1-14-5-7-16(19(23)26-2)11-17(14)27(24,25)21-13-15-6-8-18(20-12-15)22-9-3-4-10-22/h5-8,11-12,21H,3-4,9-10,13H2,1-2H3