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

Systemtic Name: 5-methyl-2-(octylamino)-4-oxidanylidene-N-(4-phenylbutyl)thieno[2,3-d][1,3]oxazine-6-carboxamide Openeye Name: 5-methyl-2-(octylamino)-4-oxo-N-(4-phenylbutyl)thieno[2,3-d][1,3]oxazine-6-carboxamide CAS Name: 5-methyl-2-(octylamino)-4-oxo-N-(4-phenylbutyl)-6-thieno[2,3-d][1,3]oxazinecarboxamide IUPAC Name: 5-methyl-2-(octylamino)-4-oxo-N-(4-phenylbutyl)thieno[2,3-d][1,3]oxazine-6-carboxamide Traditional Name: 4-keto-5-methyl-2-(octylamino)-N-(4-phenylbutyl)thieno[2,3-d][1,3]oxazine-6-carboxamide Formula: C26H35N3O3S MolecularWeight: 469.6394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC1=NC2=C(C(=C(S2)C(=O)NCCCCC3=CC=CC=C3)C)C(=O)O1

Isomeric SMILES

CCCCCCCCNC1=NC2=C(C(=C(S2)C(=O)NCCCCC3=CC=CC=C3)C)C(=O)O1

InChI

InChI=1S/C26H35N3O3S/c1-3-4-5-6-7-12-18-28-26-29-24-21(25(31)32-26)19(2)22(33-24)23(30)27-17-13-11-16-20-14-9-8-10-15-20/h8-10,14-15H,3-7,11-13,16-18H2,1-2H3,(H,27,30)(H,28,29)