5-methyl-2-(octylamino)-4-oxidanylidene-N-(2-pyridin-3-ylethyl)thieno[2,3-d][1,3]oxazine-6-carboxamide

Systemtic Name: 5-methyl-2-(octylamino)-4-oxidanylidene-N-(2-pyridin-3-ylethyl)thieno[2,3-d][1,3]oxazine-6-carboxamide Openeye Name: 5-methyl-2-(octylamino)-4-oxo-N-[2-(3-pyridyl)ethyl]thieno[2,3-d][1,3]oxazine-6-carboxamide CAS Name: 5-methyl-2-(octylamino)-4-oxo-N-[2-(3-pyridinyl)ethyl]-6-thieno[2,3-d][1,3]oxazinecarboxamide IUPAC Name: 5-methyl-2-(octylamino)-4-oxo-N-(2-pyridin-3-ylethyl)thieno[2,3-d][1,3]oxazine-6-carboxamide Traditional Name: 4-keto-5-methyl-2-(octylamino)-N-[2-(3-pyridyl)ethyl]thieno[2,3-d][1,3]oxazine-6-carboxamide Formula: C23H30N4O3S MolecularWeight: 442.5743

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC1=NC2=C(C(=C(S2)C(=O)NCCC3=CN=CC=C3)C)C(=O)O1

Isomeric SMILES

CCCCCCCCNC1=NC2=C(C(=C(S2)C(=O)NCCC3=CN=CC=C3)C)C(=O)O1

InChI

InChI=1S/C23H30N4O3S/c1-3-4-5-6-7-8-13-26-23-27-21-18(22(29)30-23)16(2)19(31-21)20(28)25-14-11-17-10-9-12-24-15-17/h9-10,12,15H,3-8,11,13-14H2,1-2H3,(H,25,28)(H,26,27)