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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C2CCCN(C2)C3=NN=C(S3)N4C(=CC=C4C)C

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C2CCCN(C2)C3=NN=C(S3)N4C(=CC=C4C)C

InChI

InChI=1S/C21H25N5OS/c1-14-7-4-5-9-18(14)22-19(27)17-8-6-12-25(13-17)20-23-24-21(28-20)26-15(2)10-11-16(26)3/h4-5,7,9-11,17H,6,8,12-13H2,1-3H3,(H,22,27)