3-[4-(aminomethyl)phenyl]-N-[2-(methylamino)ethyl]-N-propyl-1-benzothiophene-5-carboxamide

Systemtic Name: 3-[4-(aminomethyl)phenyl]-N-[2-(methylamino)ethyl]-N-propyl-1-benzothiophene-5-carboxamide Openeye Name: 3-[4-(aminomethyl)phenyl]-N-[2-(methylamino)ethyl]-N-propyl-benzothiophene-5-carboxamide CAS Name: 3-[4-(aminomethyl)phenyl]-N-[2-(methylamino)ethyl]-N-propyl-1-benzothiophene-5-carboxamide IUPAC Name: 3-[4-(aminomethyl)phenyl]-N-[2-(methylamino)ethyl]-N-propyl-1-benzothiophene-5-carboxamide Traditional Name: 3-[4-(aminomethyl)phenyl]-N-[2-(methylamino)ethyl]-N-propyl-benzothiophene-5-carboxamide Formula: C22H27N3OS MolecularWeight: 381.53428

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCNC)C(=O)C1=CC2=C(C=C1)SC=C2C3=CC=C(C=C3)CN

Isomeric SMILES

CCCN(CCNC)C(=O)C1=CC2=C(C=C1)SC=C2C3=CC=C(C=C3)CN

InChI

InChI=1S/C22H27N3OS/c1-3-11-25(12-10-24-2)22(26)18-8-9-21-19(13-18)20(15-27-21)17-6-4-16(14-23)5-7-17/h4-9,13,15,24H,3,10-12,14,23H2,1-2H3