N-(1H-benzimidazol-2-ylmethyl)-2-[1-(3-methoxyphenyl)imidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(1H-benzimidazol-2-ylmethyl)-2-[1-(3-methoxyphenyl)imidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-(1H-benzimidazol-2-ylmethyl)-2-[1-(3-methoxyphenyl)imidazol-2-yl]sulfanyl-acetamide CAS Name: N-(1H-benzimidazol-2-ylmethyl)-2-[[1-(3-methoxyphenyl)-2-imidazolyl]thio]acetamide IUPAC Name: N-(1H-benzimidazol-2-ylmethyl)-2-[1-(3-methoxyphenyl)imidazol-2-yl]sulfanylacetamide Traditional Name: N-(1H-benzimidazol-2-ylmethyl)-2-[[1-(3-methoxyphenyl)imidazol-2-yl]thio]acetamide Formula: C20H19N5O2S MolecularWeight: 393.46216

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C=CN=C2SCC(=O)NCC3=NC4=CC=CC=C4N3

Isomeric SMILES

COC1=CC=CC(=C1)N2C=CN=C2SCC(=O)NCC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C20H19N5O2S/c1-27-15-6-4-5-14(11-15)25-10-9-21-20(25)28-13-19(26)22-12-18-23-16-7-2-3-8-17(16)24-18/h2-11H,12-13H2,1H3,(H,22,26)(H,23,24)