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

Systemtic Name: N-(4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)-2-(1-phenylbenzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(4-chloro-3-morpholinosulfonyl-phenyl)-2-(1-phenylbenzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-[4-chloro-3-(4-morpholinylsulfonyl)phenyl]-2-[(1-phenyl-2-benzimidazolyl)thio]acetamide IUPAC Name: N-(4-chloro-3-morpholin-4-ylsulfonylphenyl)-2-(1-phenylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: N-(4-chloro-3-morpholinosulfonyl-phenyl)-2-[(1-phenylbenzimidazol-2-yl)thio]acetamide Formula: C25H23ClN4O4S2 MolecularWeight: 543.05752

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)NC(=O)CSC3=NC4=CC=CC=C4N3C5=CC=CC=C5)Cl

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)NC(=O)CSC3=NC4=CC=CC=C4N3C5=CC=CC=C5)Cl

InChI

InChI=1S/C25H23ClN4O4S2/c26-20-11-10-18(16-23(20)36(32,33)29-12-14-34-15-13-29)27-24(31)17-35-25-28-21-8-4-5-9-22(21)30(25)19-6-2-1-3-7-19/h1-11,16H,12-15,17H2,(H,27,31)