N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-5-morpholin-4-yl-4-phenyl-thiophene-2-carboxamide

Systemtic Name: N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-5-morpholin-4-yl-4-phenyl-thiophene-2-carboxamide Openeye Name: N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-5-morpholino-4-phenyl-thiophene-2-carboxamide CAS Name: N-[[2-(4-morpholin-4-iumylmethyl)phenyl]methyl]-5-(4-morpholinyl)-4-phenyl-2-thiophenecarboxamide IUPAC Name: N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-5-morpholin-4-yl-4-phenylthiophene-2-carboxamide Traditional Name: N-[2-(morpholin-4-ium-4-ylmethyl)benzyl]-5-morpholino-4-phenyl-thiophene-2-carboxamide Formula: C27H32N3O3S+ MolecularWeight: 478.62628

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=CC=CC=C2CNC(=O)C3=CC(=C(S3)N4CCOCC4)C5=CC=CC=C5

Isomeric SMILES

C1COCC[NH+]1CC2=CC=CC=C2CNC(=O)C3=CC(=C(S3)N4CCOCC4)C5=CC=CC=C5

InChI

InChI=1S/C27H31N3O3S/c31-26(28-19-22-8-4-5-9-23(22)20-29-10-14-32-15-11-29)25-18-24(21-6-2-1-3-7-21)27(34-25)30-12-16-33-17-13-30/h1-9,18H,10-17,19-20H2,(H,28,31)/p+1