N-[5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]-1-phenyl-piperidine-4-carboxamide

Systemtic Name: N-[5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]-1-phenyl-piperidine-4-carboxamide Openeye Name: N-[5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]-1-phenyl-piperidine-4-carboxamide CAS Name: N-[5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]-1-phenyl-4-piperidinecarboxamide IUPAC Name: N-[5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]-1-phenylpiperidine-4-carboxamide Traditional Name: 1-phenyl-N-(5-veratryl-1,3,4-thiadiazol-2-yl)isonipecotamide Formula: C23H26N4O3S MolecularWeight: 438.54254

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC2=NN=C(S2)NC(=O)C3CCN(CC3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC2=NN=C(S2)NC(=O)C3CCN(CC3)C4=CC=CC=C4)OC

InChI

InChI=1S/C23H26N4O3S/c1-29-19-9-8-16(14-20(19)30-2)15-21-25-26-23(31-21)24-22(28)17-10-12-27(13-11-17)18-6-4-3-5-7-18/h3-9,14,17H,10-13,15H2,1-2H3,(H,24,26,28)