N-[(Z)-[4-methoxy-3-(morpholin-4-ium-4-ylmethyl)phenyl]methylideneamino]-1-benzothiophene-3-carboxamide

Systemtic Name: N-[(Z)-[4-methoxy-3-(morpholin-4-ium-4-ylmethyl)phenyl]methylideneamino]-1-benzothiophene-3-carboxamide Openeye Name: N-[(Z)-[4-methoxy-3-(morpholin-4-ium-4-ylmethyl)phenyl]methyleneamino]benzothiophene-3-carboxamide CAS Name: N-[(Z)-[4-methoxy-3-(4-morpholin-4-iumylmethyl)phenyl]methylideneamino]-1-benzothiophene-3-carboxamide IUPAC Name: N-[(Z)-[4-methoxy-3-(morpholin-4-ium-4-ylmethyl)phenyl]methylideneamino]-1-benzothiophene-3-carboxamide Traditional Name: N-[(Z)-[4-methoxy-3-(morpholin-4-ium-4-ylmethyl)benzylidene]amino]benzothiophene-3-carboxamide Formula: C22H24N3O3S+ MolecularWeight: 410.50926

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=NNC(=O)C2=CSC3=CC=CC=C32)C[NH+]4CCOCC4

Isomeric SMILES

COC1=C(C=C(C=C1)/C=N\NC(=O)C2=CSC3=CC=CC=C32)C[NH+]4CCOCC4

InChI

InChI=1S/C22H23N3O3S/c1-27-20-7-6-16(12-17(20)14-25-8-10-28-11-9-25)13-23-24-22(26)19-15-29-21-5-3-2-4-18(19)21/h2-7,12-13,15H,8-11,14H2,1H3,(H,24,26)/p+1/b23-13-