3-[5-(diethylsulfamoyl)-1-methyl-benzimidazol-2-yl]-N-(1H-1,2,4-triazol-5-yl)propanimidate

Systemtic Name: 3-[5-(diethylsulfamoyl)-1-methyl-benzimidazol-2-yl]-N-(1H-1,2,4-triazol-5-yl)propanimidate Openeye Name: 3-[5-(diethylsulfamoyl)-1-methyl-benzimidazol-2-yl]-N-(1H-1,2,4-triazol-5-yl)propanimidate CAS Name: 3-[5-(diethylsulfamoyl)-1-methyl-2-benzimidazolyl]-N-(1H-1,2,4-triazol-5-yl)propanimidate IUPAC Name: 3-[5-(diethylsulfamoyl)-1-methylbenzimidazol-2-yl]-N-(1H-1,2,4-triazol-5-yl)propanimidate Traditional Name: 3-[5-(diethylsulfamoyl)-1-methyl-benzimidazol-2-yl]-N-(1H-1,2,4-triazol-5-yl)propionimidate Formula: C17H22N7O3S- MolecularWeight: 404.46668

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N(C(=N2)CCC(=NC3=NC=NN3)[O-])C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N(C(=N2)CCC(=NC3=NC=NN3)[O-])C

InChI

InChI=1S/C17H23N7O3S/c1-4-24(5-2)28(26,27)12-6-7-14-13(10-12)20-15(23(14)3)8-9-16(25)21-17-18-11-19-22-17/h6-7,10-11H,4-5,8-9H2,1-3H3,(H2,18,19,21,22,25)/p-1