2-methyl-5-pyrrolidin-1-ylsulfonyl-N-(1H-1,2,4-triazol-5-yl)benzenecarboximidate

Systemtic Name: 2-methyl-5-pyrrolidin-1-ylsulfonyl-N-(1H-1,2,4-triazol-5-yl)benzenecarboximidate Openeye Name: 2-methyl-5-pyrrolidin-1-ylsulfonyl-N-(1H-1,2,4-triazol-5-yl)benzenecarboximidate CAS Name: 2-methyl-5-(1-pyrrolidinylsulfonyl)-N-(1H-1,2,4-triazol-5-yl)benzenecarboximidate IUPAC Name: 2-methyl-5-pyrrolidin-1-ylsulfonyl-N-(1H-1,2,4-triazol-5-yl)benzenecarboximidate Traditional Name: 2-methyl-5-pyrrolidinosulfonyl-N-(1H-1,2,4-triazol-5-yl)benzenecarboximidate Formula: C14H16N5O3S- MolecularWeight: 334.37354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=NC3=NC=NN3)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=NC3=NC=NN3)[O-]

InChI

InChI=1S/C14H17N5O3S/c1-10-4-5-11(23(21,22)19-6-2-3-7-19)8-12(10)13(20)17-14-15-9-16-18-14/h4-5,8-9H,2-3,6-7H2,1H3,(H2,15,16,17,18,20)/p-1