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

Systemtic Name: N-(2-bromophenyl)-1-[5-(2,5-dimethylpyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-3-carboxamide Openeye Name: N-(2-bromophenyl)-1-[5-(2,5-dimethylpyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-3-carboxamide CAS Name: N-(2-bromophenyl)-1-[5-(2,5-dimethyl-1-pyrrolyl)-1,3,4-thiadiazol-2-yl]-3-piperidinecarboxamide IUPAC Name: N-(2-bromophenyl)-1-[5-(2,5-dimethylpyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-3-carboxamide Traditional Name: N-(2-bromophenyl)-1-[5-(2,5-dimethylpyrrol-1-yl)-1,3,4-thiadiazol-2-yl]nipecotamide Formula: C20H22BrN5OS MolecularWeight: 460.39058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=NN=C(S2)N3CCCC(C3)C(=O)NC4=CC=CC=C4Br)C

Isomeric SMILES

CC1=CC=C(N1C2=NN=C(S2)N3CCCC(C3)C(=O)NC4=CC=CC=C4Br)C

InChI

InChI=1S/C20H22BrN5OS/c1-13-9-10-14(2)26(13)20-24-23-19(28-20)25-11-5-6-15(12-25)18(27)22-17-8-4-3-7-16(17)21/h3-4,7-10,15H,5-6,11-12H2,1-2H3,(H,22,27)