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

Systemtic Name: N-cycloheptyl-1-[5-(2,5-dimethylpyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide Openeye Name: N-cycloheptyl-1-[5-(2,5-dimethylpyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide CAS Name: N-cycloheptyl-1-[5-(2,5-dimethyl-1-pyrrolyl)-1,3,4-thiadiazol-2-yl]-4-piperidinecarboxamide IUPAC Name: N-cycloheptyl-1-[5-(2,5-dimethylpyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide Traditional Name: N-cycloheptyl-1-[5-(2,5-dimethylpyrrol-1-yl)-1,3,4-thiadiazol-2-yl]isonipecotamide Formula: C21H31N5OS MolecularWeight: 401.56874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=NN=C(S2)N3CCC(CC3)C(=O)NC4CCCCCC4)C

Isomeric SMILES

CC1=CC=C(N1C2=NN=C(S2)N3CCC(CC3)C(=O)NC4CCCCCC4)C

InChI

InChI=1S/C21H31N5OS/c1-15-9-10-16(2)26(15)21-24-23-20(28-21)25-13-11-17(12-14-25)19(27)22-18-7-5-3-4-6-8-18/h9-10,17-18H,3-8,11-14H2,1-2H3,(H,22,27)