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

Systemtic Name: 3-(1-methyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)-N-(pyridin-3-ylmethyl)propanamide Openeye Name: 3-(1-methyl-5-morpholinosulfonyl-benzimidazol-2-yl)-N-(3-pyridylmethyl)propanamide CAS Name: 3-[1-methyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]-N-(3-pyridinylmethyl)propanamide IUPAC Name: 3-(1-methyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)-N-(pyridin-3-ylmethyl)propanamide Traditional Name: 3-(1-methyl-5-morpholinosulfonyl-benzimidazol-2-yl)-N-(3-pyridylmethyl)propionamide Formula: C21H25N5O4S MolecularWeight: 443.5193

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CCC(=O)NCC4=CN=CC=C4

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CCC(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C21H25N5O4S/c1-25-19-5-4-17(31(28,29)26-9-11-30-12-10-26)13-18(19)24-20(25)6-7-21(27)23-15-16-3-2-8-22-14-16/h2-5,8,13-14H,6-7,9-12,15H2,1H3,(H,23,27)