3,6-bis(chloranyl)-N-[2-(3-morpholin-4-ium-4-ylpropylcarbamoyl)phenyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3,6-bis(chloranyl)-N-[2-(3-morpholin-4-ium-4-ylpropylcarbamoyl)phenyl]-1-benzothiophene-2-carboxamide Openeye Name: 3,6-dichloro-N-[2-(3-morpholin-4-ium-4-ylpropylcarbamoyl)phenyl]benzothiophene-2-carboxamide CAS Name: 3,6-dichloro-N-[2-[[3-(4-morpholin-4-iumyl)propylamino]-oxomethyl]phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3,6-dichloro-N-[2-(3-morpholin-4-ium-4-ylpropylcarbamoyl)phenyl]-1-benzothiophene-2-carboxamide Traditional Name: 3,6-dichloro-N-[2-(3-morpholin-4-ium-4-ylpropylcarbamoyl)phenyl]benzothiophene-2-carboxamide Formula: C23H24Cl2N3O3S+ MolecularWeight: 493.42596

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC(=O)C2=CC=CC=C2NC(=O)C3=C(C4=C(S3)C=C(C=C4)Cl)Cl

Isomeric SMILES

C1COCC[NH+]1CCCNC(=O)C2=CC=CC=C2NC(=O)C3=C(C4=C(S3)C=C(C=C4)Cl)Cl

InChI

InChI=1S/C23H23Cl2N3O3S/c24-15-6-7-17-19(14-15)32-21(20(17)25)23(30)27-18-5-2-1-4-16(18)22(29)26-8-3-9-28-10-12-31-13-11-28/h1-2,4-7,14H,3,8-13H2,(H,26,29)(H,27,30)/p+1