N-(2-methyl-1,3-benzoxazol-5-yl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: N-(2-methyl-1,3-benzoxazol-5-yl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Openeye Name: N-(2-methyl-1,3-benzoxazol-5-yl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide CAS Name: N-(2-methyl-1,3-benzoxazol-5-yl)-3-[4-(1-pyrrolidinylsulfonyl)phenyl]propanamide IUPAC Name: N-(2-methyl-1,3-benzoxazol-5-yl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Traditional Name: N-(2-methyl-1,3-benzoxazol-5-yl)-3-(4-pyrrolidinosulfonylphenyl)propionamide Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(O1)C=CC(=C2)NC(=O)CCC3=CC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=NC2=C(O1)C=CC(=C2)NC(=O)CCC3=CC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C21H23N3O4S/c1-15-22-19-14-17(7-10-20(19)28-15)23-21(25)11-6-16-4-8-18(9-5-16)29(26,27)24-12-2-3-13-24/h4-5,7-10,14H,2-3,6,11-13H2,1H3,(H,23,25)