N-(2-morpholin-4-ium-4-ylethyl)-2-pyrrol-1-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: N-(2-morpholin-4-ium-4-ylethyl)-2-pyrrol-1-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: N-(2-morpholin-4-ium-4-ylethyl)-2-pyrrol-1-yl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: N-[2-(4-morpholin-4-iumyl)ethyl]-2-(1-pyrrolyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-(2-morpholin-4-ium-4-ylethyl)-2-pyrrol-1-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: N-(2-morpholin-4-ium-4-ylethyl)-2-pyrrol-1-yl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C19H26N3O2S+ MolecularWeight: 360.49364

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)N3C=CC=C3)C(=O)NCC[NH+]4CCOCC4

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)N3C=CC=C3)C(=O)NCC[NH+]4CCOCC4

InChI

InChI=1S/C19H25N3O2S/c23-18(20-7-10-21-11-13-24-14-12-21)17-15-5-1-2-6-16(15)25-19(17)22-8-3-4-9-22/h3-4,8-9H,1-2,5-7,10-14H2,(H,20,23)/p+1