2-(1H-benzimidazol-2-ylsulfanyl)-N-[5-(4-bromophenyl)-6H-1,3,4-thiadiazin-2-yl]butanamide

Systemtic Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[5-(4-bromophenyl)-6H-1,3,4-thiadiazin-2-yl]butanamide Openeye Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[5-(4-bromophenyl)-6H-1,3,4-thiadiazin-2-yl]butanamide CAS Name: 2-(1H-benzimidazol-2-ylthio)-N-[5-(4-bromophenyl)-6H-1,3,4-thiadiazin-2-yl]butanamide IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[5-(4-bromophenyl)-6H-1,3,4-thiadiazin-2-yl]butanamide Traditional Name: 2-(1H-benzimidazol-2-ylthio)-N-[5-(4-bromophenyl)-6H-1,3,4-thiadiazin-2-yl]butyramide Formula: C20H18BrN5OS2 MolecularWeight: 488.42382

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NN=C(CS1)C2=CC=C(C=C2)Br)SC3=NC4=CC=CC=C4N3

Isomeric SMILES

CCC(C(=O)NC1=NN=C(CS1)C2=CC=C(C=C2)Br)SC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C20H18BrN5OS2/c1-2-17(29-19-22-14-5-3-4-6-15(14)23-19)18(27)24-20-26-25-16(11-28-20)12-7-9-13(21)10-8-12/h3-10,17H,2,11H2,1H3,(H,22,23)(H,24,26,27)