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

Systemtic Name: N-[3-[(phenylmethyl)-propan-2-yl-amino]propyl]-2-piperidin-1-yl-1,3-benzothiazole-6-carboxamide Openeye Name: N-[3-[benzyl(isopropyl)amino]propyl]-2-(1-piperidyl)-1,3-benzothiazole-6-carboxamide CAS Name: N-[3-[(phenylmethyl)-propan-2-ylamino]propyl]-2-(1-piperidinyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: N-[3-[benzyl(propan-2-yl)amino]propyl]-2-piperidin-1-yl-1,3-benzothiazole-6-carboxamide Traditional Name: N-[3-[benzyl(isopropyl)amino]propyl]-2-piperidino-1,3-benzothiazole-6-carboxamide Formula: C26H34N4OS MolecularWeight: 450.63936

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCCNC(=O)C1=CC2=C(C=C1)N=C(S2)N3CCCCC3)CC4=CC=CC=C4

Isomeric SMILES

CC(C)N(CCCNC(=O)C1=CC2=C(C=C1)N=C(S2)N3CCCCC3)CC4=CC=CC=C4

InChI

InChI=1S/C26H34N4OS/c1-20(2)30(19-21-10-5-3-6-11-21)17-9-14-27-25(31)22-12-13-23-24(18-22)32-26(28-23)29-15-7-4-8-16-29/h3,5-6,10-13,18,20H,4,7-9,14-17,19H2,1-2H3,(H,27,31)