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

Systemtic Name: N-(3-ethynylphenyl)-3-(1-methyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)propanamide Openeye Name: N-(3-ethynylphenyl)-3-(1-methyl-5-morpholinosulfonyl-benzimidazol-2-yl)propanamide CAS Name: N-(3-ethynylphenyl)-3-[1-methyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]propanamide IUPAC Name: N-(3-ethynylphenyl)-3-(1-methyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)propanamide Traditional Name: N-(3-ethynylphenyl)-3-(1-methyl-5-morpholinosulfonyl-benzimidazol-2-yl)propionamide Formula: C23H24N4O4S MolecularWeight: 452.52606

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CCC(=O)NC4=CC=CC(=C4)C#C

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CCC(=O)NC4=CC=CC(=C4)C#C

InChI

InChI=1S/C23H24N4O4S/c1-3-17-5-4-6-18(15-17)24-23(28)10-9-22-25-20-16-19(7-8-21(20)26(22)2)32(29,30)27-11-13-31-14-12-27/h1,4-8,15-16H,9-14H2,2H3,(H,24,28)