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

Systemtic Name: N-aminocarbonyl-2-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)sulfanyl-propanamide Openeye Name: N-carbamoyl-2-(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)sulfanyl-propanamide CAS Name: N-carbamoyl-2-[[1-ethyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]thio]propanamide IUPAC Name: N-carbamoyl-2-(1-ethyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)sulfanylpropanamide Traditional Name: N-carbamoyl-2-[(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)thio]propionamide Formula: C17H23N5O5S2 MolecularWeight: 441.52502

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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)N

Isomeric SMILES

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

InChI

InChI=1S/C17H23N5O5S2/c1-3-22-14-5-4-12(29(25,26)21-6-8-27-9-7-21)10-13(14)19-17(22)28-11(2)15(23)20-16(18)24/h4-5,10-11H,3,6-9H2,1-2H3,(H3,18,20,23,24)