1-[5-(2,5-dimethylpyrrol-1-yl)-1,3,4-thiadiazol-2-yl]-N-phenethyl-piperidine-4-carboxamide

Systemtic Name: 1-[5-(2,5-dimethylpyrrol-1-yl)-1,3,4-thiadiazol-2-yl]-N-phenethyl-piperidine-4-carboxamide Openeye Name: 1-[5-(2,5-dimethylpyrrol-1-yl)-1,3,4-thiadiazol-2-yl]-N-phenethyl-piperidine-4-carboxamide CAS Name: 1-[5-(2,5-dimethyl-1-pyrrolyl)-1,3,4-thiadiazol-2-yl]-N-phenethyl-4-piperidinecarboxamide IUPAC Name: 1-[5-(2,5-dimethylpyrrol-1-yl)-1,3,4-thiadiazol-2-yl]-N-phenethylpiperidine-4-carboxamide Traditional Name: 1-[5-(2,5-dimethylpyrrol-1-yl)-1,3,4-thiadiazol-2-yl]-N-phenethyl-isonipecotamide Formula: C22H27N5OS MolecularWeight: 409.54768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=NN=C(S2)N3CCC(CC3)C(=O)NCCC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC=C(N1C2=NN=C(S2)N3CCC(CC3)C(=O)NCCC4=CC=CC=C4)C

InChI

InChI=1S/C22H27N5OS/c1-16-8-9-17(2)27(16)22-25-24-21(29-22)26-14-11-19(12-15-26)20(28)23-13-10-18-6-4-3-5-7-18/h3-9,19H,10-15H2,1-2H3,(H,23,28)