2-(4-methylpiperidin-1-yl)-N-[3-[(phenylmethyl)-propan-2-yl-amino]propyl]-1,3-benzothiazole-6-carboxamide

Systemtic Name: 2-(4-methylpiperidin-1-yl)-N-[3-[(phenylmethyl)-propan-2-yl-amino]propyl]-1,3-benzothiazole-6-carboxamide Openeye Name: N-[3-[benzyl(isopropyl)amino]propyl]-2-(4-methyl-1-piperidyl)-1,3-benzothiazole-6-carboxamide CAS Name: 2-(4-methyl-1-piperidinyl)-N-[3-[(phenylmethyl)-propan-2-ylamino]propyl]-1,3-benzothiazole-6-carboxamide IUPAC Name: N-[3-[benzyl(propan-2-yl)amino]propyl]-2-(4-methylpiperidin-1-yl)-1,3-benzothiazole-6-carboxamide Traditional Name: N-[3-[benzyl(isopropyl)amino]propyl]-2-(4-methylpiperidino)-1,3-benzothiazole-6-carboxamide Formula: C27H36N4OS MolecularWeight: 464.66594

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=NC3=C(S2)C=C(C=C3)C(=O)NCCCN(CC4=CC=CC=C4)C(C)C

Isomeric SMILES

CC1CCN(CC1)C2=NC3=C(S2)C=C(C=C3)C(=O)NCCCN(CC4=CC=CC=C4)C(C)C

InChI

InChI=1S/C27H36N4OS/c1-20(2)31(19-22-8-5-4-6-9-22)15-7-14-28-26(32)23-10-11-24-25(18-23)33-27(29-24)30-16-12-21(3)13-17-30/h4-6,8-11,18,20-21H,7,12-17,19H2,1-3H3,(H,28,32)