N-(2-chloranyl-5-methylsulfonyl-phenyl)-3-(3-methyl-2-oxidanylidene-benzimidazol-1-yl)propanamide

Systemtic Name: N-(2-chloranyl-5-methylsulfonyl-phenyl)-3-(3-methyl-2-oxidanylidene-benzimidazol-1-yl)propanamide Openeye Name: N-(2-chloro-5-methylsulfonyl-phenyl)-3-(3-methyl-2-oxo-benzimidazol-1-yl)propanamide CAS Name: N-(2-chloro-5-methylsulfonylphenyl)-3-(3-methyl-2-oxo-1-benzimidazolyl)propanamide IUPAC Name: N-(2-chloro-5-methylsulfonylphenyl)-3-(3-methyl-2-oxobenzimidazol-1-yl)propanamide Traditional Name: N-(2-chloro-5-mesyl-phenyl)-3-(2-keto-3-methyl-benzimidazol-1-yl)propionamide Formula: C18H18ClN3O4S MolecularWeight: 407.87122

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N(C1=O)CCC(=O)NC3=C(C=CC(=C3)S(=O)(=O)C)Cl

Isomeric SMILES

CN1C2=CC=CC=C2N(C1=O)CCC(=O)NC3=C(C=CC(=C3)S(=O)(=O)C)Cl

InChI

InChI=1S/C18H18ClN3O4S/c1-21-15-5-3-4-6-16(15)22(18(21)24)10-9-17(23)20-14-11-12(27(2,25)26)7-8-13(14)19/h3-8,11H,9-10H2,1-2H3,(H,20,23)