2-(3-oxidanylidene-6-pyrrolidin-1-ylsulfonyl-1,4-benzoxazin-4-yl)-N-(pyridin-3-ylmethyl)ethanamide

Systemtic Name: 2-(3-oxidanylidene-6-pyrrolidin-1-ylsulfonyl-1,4-benzoxazin-4-yl)-N-(pyridin-3-ylmethyl)ethanamide Openeye Name: 2-(3-oxo-6-pyrrolidin-1-ylsulfonyl-1,4-benzoxazin-4-yl)-N-(3-pyridylmethyl)acetamide CAS Name: 2-[3-oxo-6-(1-pyrrolidinylsulfonyl)-1,4-benzoxazin-4-yl]-N-(3-pyridinylmethyl)acetamide IUPAC Name: 2-(3-oxo-6-pyrrolidin-1-ylsulfonyl-1,4-benzoxazin-4-yl)-N-(pyridin-3-ylmethyl)acetamide Traditional Name: 2-(3-keto-6-pyrrolidinosulfonyl-1,4-benzoxazin-4-yl)-N-(3-pyridylmethyl)acetamide 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)OCC(=O)N3CC(=O)NCC4=CN=CC=C4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)OCC(=O)N3CC(=O)NCC4=CN=CC=C4

InChI

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