3-[4-(aminomethyl)phenyl]-N-(2-formamidoethyl)-N-propyl-1-benzothiophene-2-carboxamide hydrochloride

Systemtic Name: 3-[4-(aminomethyl)phenyl]-N-(2-formamidoethyl)-N-propyl-1-benzothiophene-2-carboxamide hydrochloride Openeye Name: 3-[4-(aminomethyl)phenyl]-N-(2-formamidoethyl)-N-propyl-benzothiophene-2-carboxamide hydrochloride CAS Name: 3-[4-(aminomethyl)phenyl]-N-(2-formamidoethyl)-N-propyl-1-benzothiophene-2-carboxamide hydrochloride IUPAC Name: 3-[4-(aminomethyl)phenyl]-N-(2-formamidoethyl)-N-propyl-1-benzothiophene-2-carboxamide hydrochloride Traditional Name: 3-[4-(aminomethyl)phenyl]-N-(2-formamidoethyl)-N-propyl-benzothiophene-2-carboxamide hydrochloride Formula: C22H26ClN3O2S MolecularWeight: 431.97874

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCNC=O)C(=O)C1=C(C2=CC=CC=C2S1)C3=CC=C(C=C3)CN.Cl

Isomeric SMILES

CCCN(CCNC=O)C(=O)C1=C(C2=CC=CC=C2S1)C3=CC=C(C=C3)CN.Cl

InChI

InChI=1S/C22H25N3O2S.ClH/c1-2-12-25(13-11-24-15-26)22(27)21-20(17-9-7-16(14-23)8-10-17)18-5-3-4-6-19(18)28-21;/h3-10,15H,2,11-14,23H2,1H3,(H,24,26);1H