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

Systemtic Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-N-[(4-methylphenyl)methyl]piperidine-3-carboxamide Openeye Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(p-tolylmethyl)piperidine-3-carboxamide CAS Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-N-[(4-methylphenyl)methyl]-3-piperidinecarboxamide IUPAC Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-N-[(4-methylphenyl)methyl]piperidine-3-carboxamide Traditional Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(4-methylbenzyl)nipecotamide Formula: C23H27N3O2S MolecularWeight: 409.54438

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)N3CCCC(C3)C(=O)NCC4=CC=C(C=C4)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)N3CCCC(C3)C(=O)NCC4=CC=C(C=C4)C

InChI

InChI=1S/C23H27N3O2S/c1-3-28-19-10-11-20-21(13-19)29-23(25-20)26-12-4-5-18(15-26)22(27)24-14-17-8-6-16(2)7-9-17/h6-11,13,18H,3-5,12,14-15H2,1-2H3,(H,24,27)