N-[2-[di(propan-2-yl)azaniumyl]ethyl]-4-(thiophen-2-ylsulfonylamino)benzenecarboximidate

Systemtic Name: N-[2-[di(propan-2-yl)azaniumyl]ethyl]-4-(thiophen-2-ylsulfonylamino)benzenecarboximidate Openeye Name: N-[2-(diisopropylammonio)ethyl]-4-(2-thienylsulfonylamino)benzenecarboximidate CAS Name: N-[2-[di(propan-2-yl)ammonio]ethyl]-4-(thiophen-2-ylsulfonylamino)benzenecarboximidate IUPAC Name: N-[2-[di(propan-2-yl)azaniumyl]ethyl]-4-(thiophen-2-ylsulfonylamino)benzenecarboximidate Traditional Name: N-[2-(diisopropylammonio)ethyl]-4-(2-thienylsulfonylamino)benzenecarboximidate Formula: C19H27N3O3S2 MolecularWeight: 409.56598

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CCN=C(C1=CC=C(C=C1)NS(=O)(=O)C2=CC=CS2)[O-])C(C)C

Isomeric SMILES

CC(C)[NH+](CCN=C(C1=CC=C(C=C1)NS(=O)(=O)C2=CC=CS2)[O-])C(C)C

InChI

InChI=1S/C19H27N3O3S2/c1-14(2)22(15(3)4)12-11-20-19(23)16-7-9-17(10-8-16)21-27(24,25)18-6-5-13-26-18/h5-10,13-15,21H,11-12H2,1-4H3,(H,20,23)