N-(2-cyanoethyl)-2-[(3-oxidanylidene-1,4-benzoxazin-4-yl)methyl]-N-(pyridin-3-ylmethyl)-1,3-thiazole-4-carboxamide

Systemtic Name: N-(2-cyanoethyl)-2-[(3-oxidanylidene-1,4-benzoxazin-4-yl)methyl]-N-(pyridin-3-ylmethyl)-1,3-thiazole-4-carboxamide Openeye Name: N-(2-cyanoethyl)-2-[(3-oxo-1,4-benzoxazin-4-yl)methyl]-N-(3-pyridylmethyl)thiazole-4-carboxamide CAS Name: N-(2-cyanoethyl)-2-[(3-oxo-1,4-benzoxazin-4-yl)methyl]-N-(3-pyridinylmethyl)-4-thiazolecarboxamide IUPAC Name: N-(2-cyanoethyl)-2-[(3-oxo-1,4-benzoxazin-4-yl)methyl]-N-(pyridin-3-ylmethyl)-1,3-thiazole-4-carboxamide Traditional Name: N-(2-cyanoethyl)-2-[(3-keto-1,4-benzoxazin-4-yl)methyl]-N-(3-pyridylmethyl)thiazole-4-carboxamide Formula: C22H19N5O3S MolecularWeight: 433.48296

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=CC=CC=C2O1)CC3=NC(=CS3)C(=O)N(CCC#N)CC4=CN=CC=C4

Isomeric SMILES

C1C(=O)N(C2=CC=CC=C2O1)CC3=NC(=CS3)C(=O)N(CCC#N)CC4=CN=CC=C4

InChI

InChI=1S/C22H19N5O3S/c23-8-4-10-26(12-16-5-3-9-24-11-16)22(29)17-15-31-20(25-17)13-27-18-6-1-2-7-19(18)30-14-21(27)28/h1-3,5-7,9,11,15H,4,10,12-14H2