N-(4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(4-chloro-3-morpholinosulfonyl-phenyl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-[4-chloro-3-(4-morpholinylsulfonyl)phenyl]-2-[(1-methyl-2-benzimidazolyl)thio]acetamide IUPAC Name: N-(4-chloro-3-morpholin-4-ylsulfonylphenyl)-2-(1-methylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: N-(4-chloro-3-morpholinosulfonyl-phenyl)-2-[(1-methylbenzimidazol-2-yl)thio]acetamide Formula: C20H21ClN4O4S2 MolecularWeight: 480.98814

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1SCC(=O)NC3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CN1C2=CC=CC=C2N=C1SCC(=O)NC3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C20H21ClN4O4S2/c1-24-17-5-3-2-4-16(17)23-20(24)30-13-19(26)22-14-6-7-15(21)18(12-14)31(27,28)25-8-10-29-11-9-25/h2-7,12H,8-11,13H2,1H3,(H,22,26)