1-(6-ethoxy-1,3-benzothiazol-2-yl)-N-[3-(4-methylpiperazin-1-yl)propyl]piperidine-3-carboxamide

Systemtic Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-N-[3-(4-methylpiperazin-1-yl)propyl]piperidine-3-carboxamide Openeye Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-N-[3-(4-methylpiperazin-1-yl)propyl]piperidine-3-carboxamide CAS Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-N-[3-(4-methyl-1-piperazinyl)propyl]-3-piperidinecarboxamide IUPAC Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-N-[3-(4-methylpiperazin-1-yl)propyl]piperidine-3-carboxamide Traditional Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-N-[3-(4-methylpiperazino)propyl]nipecotamide Formula: C23H35N5O2S MolecularWeight: 445.6213

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)N3CCCC(C3)C(=O)NCCCN4CCN(CC4)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)N3CCCC(C3)C(=O)NCCCN4CCN(CC4)C

InChI

InChI=1S/C23H35N5O2S/c1-3-30-19-7-8-20-21(16-19)31-23(25-20)28-11-4-6-18(17-28)22(29)24-9-5-10-27-14-12-26(2)13-15-27/h7-8,16,18H,3-6,9-15,17H2,1-2H3,(H,24,29)