N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylpyrrol-2-yl)ethyl]-1,3-benzothiazole-2-carboxamide

Systemtic Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylpyrrol-2-yl)ethyl]-1,3-benzothiazole-2-carboxamide Openeye Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylpyrrol-2-yl)ethyl]-1,3-benzothiazole-2-carboxamide CAS Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methyl-2-pyrrolyl)ethyl]-1,3-benzothiazole-2-carboxamide IUPAC Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylpyrrol-2-yl)ethyl]-1,3-benzothiazole-2-carboxamide Traditional Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylpyrrol-2-yl)ethyl]-1,3-benzothiazole-2-carboxamide Formula: C24H24N4OS MolecularWeight: 416.53856

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(CNC(=O)C2=NC3=CC=CC=C3S2)N4CCC5=CC=CC=C5C4

Isomeric SMILES

CN1C=CC=C1C(CNC(=O)C2=NC3=CC=CC=C3S2)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C24H24N4OS/c1-27-13-6-10-20(27)21(28-14-12-17-7-2-3-8-18(17)16-28)15-25-23(29)24-26-19-9-4-5-11-22(19)30-24/h2-11,13,21H,12,14-16H2,1H3,(H,25,29)