N-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-(3-oxo-4H-1,4-benzoxazin-6-yl)-1-(3-pyridylsulfonyl)piperidine-4-carboxamide CAS Name: N-(3-oxo-4H-1,4-benzoxazin-6-yl)-1-(3-pyridinylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-(3-oxo-4H-1,4-benzoxazin-6-yl)-1-pyridin-3-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-(3-keto-4H-1,4-benzoxazin-6-yl)-1-(3-pyridylsulfonyl)isonipecotamide Formula: C19H20N4O5S MolecularWeight: 416.4509

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCC(=O)N3)S(=O)(=O)C4=CN=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCC(=O)N3)S(=O)(=O)C4=CN=CC=C4

InChI

InChI=1S/C19H20N4O5S/c24-18-12-28-17-4-3-14(10-16(17)22-18)21-19(25)13-5-8-23(9-6-13)29(26,27)15-2-1-7-20-11-15/h1-4,7,10-11,13H,5-6,8-9,12H2,(H,21,25)(H,22,24)