N-[2-[3-[4-(aminomethyl)phenyl]propyl-methyl-amino]ethyl]-1,3-benzothiazole-2-carboxamide

Systemtic Name: N-[2-[3-[4-(aminomethyl)phenyl]propyl-methyl-amino]ethyl]-1,3-benzothiazole-2-carboxamide Openeye Name: N-[2-[3-[4-(aminomethyl)phenyl]propyl-methyl-amino]ethyl]-1,3-benzothiazole-2-carboxamide CAS Name: N-[2-[3-[4-(aminomethyl)phenyl]propyl-methylamino]ethyl]-1,3-benzothiazole-2-carboxamide IUPAC Name: N-[2-[3-[4-(aminomethyl)phenyl]propyl-methylamino]ethyl]-1,3-benzothiazole-2-carboxamide Traditional Name: N-[2-[3-[4-(aminomethyl)phenyl]propyl-methyl-amino]ethyl]-1,3-benzothiazole-2-carboxamide Formula: C21H26N4OS MolecularWeight: 382.52234

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC1=CC=C(C=C1)CN)CCNC(=O)C2=NC3=CC=CC=C3S2

Isomeric SMILES

CN(CCCC1=CC=C(C=C1)CN)CCNC(=O)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C21H26N4OS/c1-25(13-4-5-16-8-10-17(15-22)11-9-16)14-12-23-20(26)21-24-18-6-2-3-7-19(18)27-21/h2-3,6-11H,4-5,12-15,22H2,1H3,(H,23,26)