N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-3-(3-bromanylphenoxy)propanamide

Systemtic Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-3-(3-bromanylphenoxy)propanamide Openeye Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-3-(3-bromophenoxy)propanamide CAS Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-3-(3-bromophenoxy)propanamide IUPAC Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-3-(3-bromophenoxy)propanamide Traditional Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-3-(3-bromophenoxy)propionamide Formula: C20H22BrN3O2S MolecularWeight: 448.37658

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)CCOC3=CC(=CC=C3)Br

Isomeric SMILES

CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)CCOC3=CC(=CC=C3)Br

InChI

InChI=1S/C20H22BrN3O2S/c1-27-12-10-18(20-23-16-7-2-3-8-17(16)24-20)22-19(25)9-11-26-15-6-4-5-14(21)13-15/h2-8,13,18H,9-12H2,1H3,(H,22,25)(H,23,24)