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

Systemtic Name: N-[3-[ethyl-(phenylmethyl)amino]propyl]-2-piperidin-1-yl-1,3-benzothiazole-6-carboxamide Openeye Name: N-[3-[benzyl(ethyl)amino]propyl]-2-(1-piperidyl)-1,3-benzothiazole-6-carboxamide CAS Name: N-[3-[ethyl-(phenylmethyl)amino]propyl]-2-(1-piperidinyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: N-[3-[benzyl(ethyl)amino]propyl]-2-piperidin-1-yl-1,3-benzothiazole-6-carboxamide Traditional Name: N-[3-[benzyl(ethyl)amino]propyl]-2-piperidino-1,3-benzothiazole-6-carboxamide Formula: C25H32N4OS MolecularWeight: 436.61278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H32N4OS/c1-2-28(19-20-10-5-3-6-11-20)15-9-14-26-24(30)21-12-13-22-23(18-21)31-25(27-22)29-16-7-4-8-17-29/h3,5-6,10-13,18H,2,4,7-9,14-17,19H2,1H3,(H,26,30)