1-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(3-methylbutyl)piperidine-3-carboxamide

Systemtic Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(3-methylbutyl)piperidine-3-carboxamide Openeye Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-N-isopentyl-piperidine-3-carboxamide CAS Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(3-methylbutyl)-3-piperidinecarboxamide IUPAC Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(3-methylbutyl)piperidine-3-carboxamide Traditional Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-N-isoamyl-nipecotamide Formula: C20H29N3O2S MolecularWeight: 375.52816

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H29N3O2S/c1-4-25-16-7-8-17-18(12-16)26-20(22-17)23-11-5-6-15(13-23)19(24)21-10-9-14(2)3/h7-8,12,14-15H,4-6,9-11,13H2,1-3H3,(H,21,24)