N-[(E)-1-(1-methylpyrrol-2-yl)-3-oxidanylidene-3-(2-pyrrolidin-1-ium-1-ylethylamino)prop-1-en-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[(E)-1-(1-methylpyrrol-2-yl)-3-oxidanylidene-3-(2-pyrrolidin-1-ium-1-ylethylamino)prop-1-en-2-yl]thiophene-2-carboxamide Openeye Name: N-[(E)-2-(1-methylpyrrol-2-yl)-1-(2-pyrrolidin-1-ium-1-ylethylcarbamoyl)vinyl]thiophene-2-carboxamide CAS Name: N-[(E)-1-(1-methyl-2-pyrrolyl)-3-oxo-3-[2-(1-pyrrolidin-1-iumyl)ethylamino]prop-1-en-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[(E)-1-(1-methylpyrrol-2-yl)-3-oxo-3-(2-pyrrolidin-1-ium-1-ylethylamino)prop-1-en-2-yl]thiophene-2-carboxamide Traditional Name: N-[(E)-2-(1-methylpyrrol-2-yl)-1-(2-pyrrolidin-1-ium-1-ylethylcarbamoyl)vinyl]thiophene-2-carboxamide Formula: C19H25N4O2S+ MolecularWeight: 373.4924

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C=C(C(=O)NCC[NH+]2CCCC2)NC(=O)C3=CC=CS3

Isomeric SMILES

CN1C=CC=C1/C=C(\C(=O)NCC[NH+]2CCCC2)/NC(=O)C3=CC=CS3

InChI

InChI=1S/C19H24N4O2S/c1-22-9-4-6-15(22)14-16(21-19(25)17-7-5-13-26-17)18(24)20-8-12-23-10-2-3-11-23/h4-7,9,13-14H,2-3,8,10-12H2,1H3,(H,20,24)(H,21,25)/p+1/b16-14+