4-azanyl-5-(4-chlorophenyl)carbonyl-2-(furan-2-ylmethylamino)-N-(2-morpholin-4-ium-4-ylethyl)thiophene-3-carboxamide

Systemtic Name: 4-azanyl-5-(4-chlorophenyl)carbonyl-2-(furan-2-ylmethylamino)-N-(2-morpholin-4-ium-4-ylethyl)thiophene-3-carboxamide Openeye Name: 4-amino-5-(4-chlorobenzoyl)-2-(2-furylmethylamino)-N-(2-morpholin-4-ium-4-ylethyl)thiophene-3-carboxamide CAS Name: 4-amino-5-[(4-chlorophenyl)-oxomethyl]-2-(2-furanylmethylamino)-N-[2-(4-morpholin-4-iumyl)ethyl]-3-thiophenecarboxamide IUPAC Name: 4-amino-5-(4-chlorobenzoyl)-2-(furan-2-ylmethylamino)-N-(2-morpholin-4-ium-4-ylethyl)thiophene-3-carboxamide Traditional Name: 4-amino-5-(4-chlorobenzoyl)-2-(2-furfurylamino)-N-(2-morpholin-4-ium-4-ylethyl)thiophene-3-carboxamide Formula: C23H26ClN4O4S+ MolecularWeight: 489.99494

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC(=O)C2=C(SC(=C2N)C(=O)C3=CC=C(C=C3)Cl)NCC4=CC=CO4

Isomeric SMILES

C1COCC[NH+]1CCNC(=O)C2=C(SC(=C2N)C(=O)C3=CC=C(C=C3)Cl)NCC4=CC=CO4

InChI

InChI=1S/C23H25ClN4O4S/c24-16-5-3-15(4-6-16)20(29)21-19(25)18(23(33-21)27-14-17-2-1-11-32-17)22(30)26-7-8-28-9-12-31-13-10-28/h1-6,11,27H,7-10,12-14,25H2,(H,26,30)/p+1