3-(2-oxidanylidene-6-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-3-yl)-N-(pyridin-3-ylmethyl)propanamide

Systemtic Name: 3-(2-oxidanylidene-6-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-3-yl)-N-(pyridin-3-ylmethyl)propanamide Openeye Name: 3-(2-oxo-6-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-3-yl)-N-(3-pyridylmethyl)propanamide CAS Name: 3-[2-oxo-6-(1-pyrrolidinylsulfonyl)-1,3-benzoxazol-3-yl]-N-(3-pyridinylmethyl)propanamide IUPAC Name: 3-(2-oxo-6-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-3-yl)-N-(pyridin-3-ylmethyl)propanamide Traditional Name: 3-(2-keto-6-pyrrolidinosulfonyl-1,3-benzoxazol-3-yl)-N-(3-pyridylmethyl)propionamide Formula: C20H22N4O5S MolecularWeight: 430.47748

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)O3)CCC(=O)NCC4=CN=CC=C4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)O3)CCC(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C20H22N4O5S/c25-19(22-14-15-4-3-8-21-13-15)7-11-24-17-6-5-16(12-18(17)29-20(24)26)30(27,28)23-9-1-2-10-23/h3-6,8,12-13H,1-2,7,9-11,14H2,(H,22,25)