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

Systemtic Name: 1-[5-(2,5-dimethylpyrrol-1-yl)-1,3,4-thiadiazol-2-yl]-N-(phenylmethyl)piperidine-3-carboxamide Openeye Name: N-benzyl-1-[5-(2,5-dimethylpyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-3-carboxamide CAS Name: 1-[5-(2,5-dimethyl-1-pyrrolyl)-1,3,4-thiadiazol-2-yl]-N-(phenylmethyl)-3-piperidinecarboxamide IUPAC Name: N-benzyl-1-[5-(2,5-dimethylpyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-3-carboxamide Traditional Name: N-benzyl-1-[5-(2,5-dimethylpyrrol-1-yl)-1,3,4-thiadiazol-2-yl]nipecotamide Formula: C21H25N5OS MolecularWeight: 395.5211

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=NN=C(S2)N3CCCC(C3)C(=O)NCC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC=C(N1C2=NN=C(S2)N3CCCC(C3)C(=O)NCC4=CC=CC=C4)C

InChI

InChI=1S/C21H25N5OS/c1-15-10-11-16(2)26(15)21-24-23-20(28-21)25-12-6-9-18(14-25)19(27)22-13-17-7-4-3-5-8-17/h3-5,7-8,10-11,18H,6,9,12-14H2,1-2H3,(H,22,27)