N-[2-(1H-benzimidazol-2-yl)ethyl]-2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanyl-acetamide CAS Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-2-[[1-(4-methoxyphenyl)-2-imidazolyl]thio]acetamide IUPAC Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanylacetamide Traditional Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-2-[[1-(4-methoxyphenyl)imidazol-2-yl]thio]acetamide Formula: C21H21N5O2S MolecularWeight: 407.48874

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C=CN=C2SCC(=O)NCCC3=NC4=CC=CC=C4N3

Isomeric SMILES

COC1=CC=C(C=C1)N2C=CN=C2SCC(=O)NCCC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C21H21N5O2S/c1-28-16-8-6-15(7-9-16)26-13-12-23-21(26)29-14-20(27)22-11-10-19-24-17-4-2-3-5-18(17)25-19/h2-9,12-13H,10-11,14H2,1H3,(H,22,27)(H,24,25)