2-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)sulfanyl-N-(methylcarbamoyl)propanamide

Systemtic Name: 2-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)sulfanyl-N-(methylcarbamoyl)propanamide Openeye Name: 2-(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)sulfanyl-N-(methylcarbamoyl)propanamide CAS Name: 2-[[1-ethyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]thio]-N-(methylcarbamoyl)propanamide IUPAC Name: 2-(1-ethyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)sulfanyl-N-(methylcarbamoyl)propanamide Traditional Name: 2-[(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)thio]-N-(methylcarbamoyl)propionamide Formula: C18H25N5O5S2 MolecularWeight: 455.5516

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SC(C)C(=O)NC(=O)NC

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SC(C)C(=O)NC(=O)NC

InChI

InChI=1S/C18H25N5O5S2/c1-4-23-15-6-5-13(30(26,27)22-7-9-28-10-8-22)11-14(15)20-18(23)29-12(2)16(24)21-17(25)19-3/h5-6,11-12H,4,7-10H2,1-3H3,(H2,19,21,24,25)