3-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)-N-(3-ethynylphenyl)propanamide

Systemtic Name: 3-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)-N-(3-ethynylphenyl)propanamide Openeye Name: 3-(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)-N-(3-ethynylphenyl)propanamide CAS Name: 3-[1-ethyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]-N-(3-ethynylphenyl)propanamide IUPAC Name: 3-(1-ethyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)-N-(3-ethynylphenyl)propanamide Traditional Name: 3-(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)-N-(3-ethynylphenyl)propionamide Formula: C24H26N4O4S MolecularWeight: 466.55264

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CCC(=O)NC4=CC=CC(=C4)C#C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CCC(=O)NC4=CC=CC(=C4)C#C

InChI

InChI=1S/C24H26N4O4S/c1-3-18-6-5-7-19(16-18)25-24(29)11-10-23-26-21-17-20(8-9-22(21)28(23)4-2)33(30,31)27-12-14-32-15-13-27/h1,5-9,16-17H,4,10-15H2,2H3,(H,25,29)