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

Systemtic Name: 4-piperidin-1-ylsulfonyl-N-(1H-1,2,4-triazol-5-yl)benzenecarboximidate Openeye Name: 4-(1-piperidylsulfonyl)-N-(1H-1,2,4-triazol-5-yl)benzenecarboximidate CAS Name: 4-(1-piperidinylsulfonyl)-N-(1H-1,2,4-triazol-5-yl)benzenecarboximidate IUPAC Name: 4-piperidin-1-ylsulfonyl-N-(1H-1,2,4-triazol-5-yl)benzenecarboximidate Traditional Name: 4-piperidinosulfonyl-N-(1H-1,2,4-triazol-5-yl)benzenecarboximidate Formula: C14H16N5O3S- MolecularWeight: 334.37354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=NC3=NC=NN3)[O-]

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=NC3=NC=NN3)[O-]

InChI

InChI=1S/C14H17N5O3S/c20-13(17-14-15-10-16-18-14)11-4-6-12(7-5-11)23(21,22)19-8-2-1-3-9-19/h4-7,10H,1-3,8-9H2,(H2,15,16,17,18,20)/p-1