N-(5-butyl-1,3,4-thiadiazol-2-yl)-1-(3,5-dimethylphenyl)carbonyl-piperidine-3-carboxamide

Systemtic Name: N-(5-butyl-1,3,4-thiadiazol-2-yl)-1-(3,5-dimethylphenyl)carbonyl-piperidine-3-carboxamide Openeye Name: N-(5-butyl-1,3,4-thiadiazol-2-yl)-1-(3,5-dimethylbenzoyl)piperidine-3-carboxamide CAS Name: N-(5-butyl-1,3,4-thiadiazol-2-yl)-1-[(3,5-dimethylphenyl)-oxomethyl]-3-piperidinecarboxamide IUPAC Name: N-(5-butyl-1,3,4-thiadiazol-2-yl)-1-(3,5-dimethylbenzoyl)piperidine-3-carboxamide Traditional Name: N-(5-butyl-1,3,4-thiadiazol-2-yl)-1-(3,5-dimethylbenzoyl)nipecotamide Formula: C21H28N4O2S MolecularWeight: 400.53762

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN=C(S1)NC(=O)C2CCCN(C2)C(=O)C3=CC(=CC(=C3)C)C

Isomeric SMILES

CCCCC1=NN=C(S1)NC(=O)C2CCCN(C2)C(=O)C3=CC(=CC(=C3)C)C

InChI

InChI=1S/C21H28N4O2S/c1-4-5-8-18-23-24-21(28-18)22-19(26)16-7-6-9-25(13-16)20(27)17-11-14(2)10-15(3)12-17/h10-12,16H,4-9,13H2,1-3H3,(H,22,24,26)