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

Systemtic Name: N-[(2-bromophenyl)methyl]-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide Openeye Name: N-[(2-bromophenyl)methyl]-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide CAS Name: N-[(2-bromophenyl)methyl]-1-[5-(1-pyrrolyl)-1,3,4-thiadiazol-2-yl]-4-piperidinecarboxamide IUPAC Name: N-[(2-bromophenyl)methyl]-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide Traditional Name: N-(2-bromobenzyl)-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)isonipecotamide Formula: C19H20BrN5OS MolecularWeight: 446.364

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CC=CC=C2Br)C3=NN=C(S3)N4C=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CC=CC=C2Br)C3=NN=C(S3)N4C=CC=C4

InChI

InChI=1S/C19H20BrN5OS/c20-16-6-2-1-5-15(16)13-21-17(26)14-7-11-25(12-8-14)19-23-22-18(27-19)24-9-3-4-10-24/h1-6,9-10,14H,7-8,11-13H2,(H,21,26)