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

Systemtic Name: N-(4-bromophenyl)-4-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]piperazine-1-carboxamide Openeye Name: 4-(3-benzyl-1,2,4-thiadiazol-5-yl)-N-(4-bromophenyl)piperazine-1-carboxamide CAS Name: N-(4-bromophenyl)-4-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]-1-piperazinecarboxamide IUPAC Name: 4-(3-benzyl-1,2,4-thiadiazol-5-yl)-N-(4-bromophenyl)piperazine-1-carboxamide Traditional Name: 4-(3-benzyl-1,2,4-thiadiazol-5-yl)-N-(4-bromophenyl)piperazine-1-carboxamide Formula: C20H20BrN5OS MolecularWeight: 458.3747

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC(=NS2)CC3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)Br

Isomeric SMILES

C1CN(CCN1C2=NC(=NS2)CC3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)Br

InChI

InChI=1S/C20H20BrN5OS/c21-16-6-8-17(9-7-16)22-19(27)25-10-12-26(13-11-25)20-23-18(24-28-20)14-15-4-2-1-3-5-15/h1-9H,10-14H2,(H,22,27)