1-(3-chlorophenyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)piperidine-4-carboxamide

Systemtic Name: 1-(3-chlorophenyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)piperidine-4-carboxamide Openeye Name: 1-(3-chlorophenyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)piperidine-4-carboxamide CAS Name: 1-(3-chlorophenyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-piperidinecarboxamide IUPAC Name: 1-(3-chlorophenyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)piperidine-4-carboxamide Traditional Name: 1-(3-chlorophenyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)isonipecotamide Formula: C21H22ClN3O2S MolecularWeight: 415.93628

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CCN(CC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CCN(CC3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C21H22ClN3O2S/c1-2-27-17-6-7-18-19(13-17)28-21(23-18)24-20(26)14-8-10-25(11-9-14)16-5-3-4-15(22)12-16/h3-7,12-14H,2,8-11H2,1H3,(H,23,24,26)