(1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl 5-methylpyrazine-2-carboxylate

Systemtic Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl 5-methylpyrazine-2-carboxylate Openeye Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl 5-methylpyrazine-2-carboxylate CAS Name: 5-methyl-2-pyrazinecarboxylic acid (1-butyl-5-sulfamoyl-2-benzimidazolyl)methyl ester IUPAC Name: (1-butyl-5-sulfamoylbenzimidazol-2-yl)methyl 5-methylpyrazine-2-carboxylate Traditional Name: 5-methylpyrazinic acid (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl ester Formula: C18H21N5O4S MolecularWeight: 403.45544

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1COC(=O)C3=CN=C(C=N3)C

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1COC(=O)C3=CN=C(C=N3)C

InChI

InChI=1S/C18H21N5O4S/c1-3-4-7-23-16-6-5-13(28(19,25)26)8-14(16)22-17(23)11-27-18(24)15-10-20-12(2)9-21-15/h5-6,8-10H,3-4,7,11H2,1-2H3,(H2,19,25,26)