N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-1-ium-4-yl]-4-(thiophen-2-ylsulfonylamino)benzenecarboximidate

Systemtic Name: N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-1-ium-4-yl]-4-(thiophen-2-ylsulfonylamino)benzenecarboximidate Openeye Name: N-[1-(2-amino-2-oxo-ethyl)piperidin-1-ium-4-yl]-4-(2-thienylsulfonylamino)benzenecarboximidate CAS Name: N-[1-(2-amino-2-oxoethyl)-4-piperidin-1-iumyl]-4-(thiophen-2-ylsulfonylamino)benzenecarboximidate IUPAC Name: N-[1-(2-amino-2-oxoethyl)piperidin-1-ium-4-yl]-4-(thiophen-2-ylsulfonylamino)benzenecarboximidate Traditional Name: N-[1-(2-amino-2-keto-ethyl)piperidin-1-ium-4-yl]-4-(2-thienylsulfonylamino)benzenecarboximidate Formula: C18H22N4O4S2 MolecularWeight: 422.52168

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1N=C(C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CS3)[O-])CC(=O)N

Isomeric SMILES

C1C[NH+](CCC1N=C(C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CS3)[O-])CC(=O)N

InChI

InChI=1S/C18H22N4O4S2/c19-16(23)12-22-9-7-14(8-10-22)20-18(24)13-3-5-15(6-4-13)21-28(25,26)17-2-1-11-27-17/h1-6,11,14,21H,7-10,12H2,(H2,19,23)(H,20,24)