4-(4-methylpiperidin-1-yl)sulfonyl-N-(1H-1,2,4-triazol-5-yl)benzenecarboximidate

Systemtic Name: 4-(4-methylpiperidin-1-yl)sulfonyl-N-(1H-1,2,4-triazol-5-yl)benzenecarboximidate Openeye Name: 4-[(4-methyl-1-piperidyl)sulfonyl]-N-(1H-1,2,4-triazol-5-yl)benzenecarboximidate CAS Name: 4-[(4-methyl-1-piperidinyl)sulfonyl]-N-(1H-1,2,4-triazol-5-yl)benzenecarboximidate IUPAC Name: 4-(4-methylpiperidin-1-yl)sulfonyl-N-(1H-1,2,4-triazol-5-yl)benzenecarboximidate Traditional Name: 4-(4-methylpiperidino)sulfonyl-N-(1H-1,2,4-triazol-5-yl)benzenecarboximidate Formula: C15H18N5O3S- MolecularWeight: 348.40012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=NC3=NC=NN3)[O-]

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=NC3=NC=NN3)[O-]

InChI

InChI=1S/C15H19N5O3S/c1-11-6-8-20(9-7-11)24(22,23)13-4-2-12(3-5-13)14(21)18-15-16-10-17-19-15/h2-5,10-11H,6-9H2,1H3,(H2,16,17,18,19,21)/p-1