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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)N3CCC(CC3)C(=O)NCC4=CC=C(C=C4)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)N3CCC(CC3)C(=O)NCC4=CC=C(C=C4)C

InChI

InChI=1S/C23H27N3O2S/c1-3-28-19-8-9-20-21(14-19)29-23(25-20)26-12-10-18(11-13-26)22(27)24-15-17-6-4-16(2)5-7-17/h4-9,14,18H,3,10-13,15H2,1-2H3,(H,24,27)