5-(cyclopropylcarbonylamino)-3-methyl-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]thiophene-2-carboxamide

Systemtic Name: 5-(cyclopropylcarbonylamino)-3-methyl-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]thiophene-2-carboxamide Openeye Name: 5-(cyclopropanecarbonylamino)-3-methyl-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]thiophene-2-carboxamide CAS Name: 5-[[cyclopropyl(oxo)methyl]amino]-3-methyl-N-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]-2-thiophenecarboxamide IUPAC Name: 5-(cyclopropanecarbonylamino)-3-methyl-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]thiophene-2-carboxamide Traditional Name: 5-(cyclopropanecarbonylamino)-3-methyl-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]thiophene-2-carboxamide Formula: C20H25N4O3S+ MolecularWeight: 401.5025

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)NC(=O)C2CC2)C(=O)NCC3=C[NH+]=C(C=C3)N4CCOCC4

Isomeric SMILES

CC1=C(SC(=C1)NC(=O)C2CC2)C(=O)NCC3=C[NH+]=C(C=C3)N4CCOCC4

InChI

InChI=1S/C20H24N4O3S/c1-13-10-17(23-19(25)15-3-4-15)28-18(13)20(26)22-12-14-2-5-16(21-11-14)24-6-8-27-9-7-24/h2,5,10-11,15H,3-4,6-9,12H2,1H3,(H,22,26)(H,23,25)/p+1