N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-N-(3-morpholin-4-ium-4-ylpropyl)thiophene-2-carboxamide

Systemtic Name: N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-N-(3-morpholin-4-ium-4-ylpropyl)thiophene-2-carboxamide Openeye Name: N-[4-(4-methoxyphenyl)thiazol-2-yl]-N-(3-morpholin-4-ium-4-ylpropyl)thiophene-2-carboxamide CAS Name: N-[4-(4-methoxyphenyl)-2-thiazolyl]-N-[3-(4-morpholin-4-iumyl)propyl]-2-thiophenecarboxamide IUPAC Name: N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-N-(3-morpholin-4-ium-4-ylpropyl)thiophene-2-carboxamide Traditional Name: N-[4-(4-methoxyphenyl)thiazol-2-yl]-N-(3-morpholin-4-ium-4-ylpropyl)thiophene-2-carboxamide Formula: C22H26N3O3S2+ MolecularWeight: 444.59014

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CSC(=N2)N(CCC[NH+]3CCOCC3)C(=O)C4=CC=CS4

Isomeric SMILES

COC1=CC=C(C=C1)C2=CSC(=N2)N(CCC[NH+]3CCOCC3)C(=O)C4=CC=CS4

InChI

InChI=1S/C22H25N3O3S2/c1-27-18-7-5-17(6-8-18)19-16-30-22(23-19)25(21(26)20-4-2-15-29-20)10-3-9-24-11-13-28-14-12-24/h2,4-8,15-16H,3,9-14H2,1H3/p+1