6-methyl-4-oxidanylidene-N-[(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)methyl]-5-(1-phenylethyl)-3H-thieno[2,3-d]pyrimidine-2-carboxamide

Systemtic Name: 6-methyl-4-oxidanylidene-N-[(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)methyl]-5-(1-phenylethyl)-3H-thieno[2,3-d]pyrimidine-2-carboxamide Openeye Name: 6-methyl-4-oxo-N-[(3-oxo-4H-1,4-benzoxazin-6-yl)methyl]-5-(1-phenylethyl)-3H-thieno[2,3-d]pyrimidine-2-carboxamide CAS Name: 6-methyl-4-oxo-N-[(3-oxo-4H-1,4-benzoxazin-6-yl)methyl]-5-(1-phenylethyl)-3H-thieno[2,3-d]pyrimidine-2-carboxamide IUPAC Name: 6-methyl-4-oxo-N-[(3-oxo-4H-1,4-benzoxazin-6-yl)methyl]-5-(1-phenylethyl)-3H-thieno[2,3-d]pyrimidine-2-carboxamide Traditional Name: 4-keto-N-[(3-keto-4H-1,4-benzoxazin-6-yl)methyl]-6-methyl-5-(1-phenylethyl)-3H-thieno[2,3-d]pyrimidine-2-carboxamide Formula: C25H22N4O4S MolecularWeight: 474.53158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)N=C(NC2=O)C(=O)NCC3=CC4=C(C=C3)OCC(=O)N4)C(C)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C2=C(S1)N=C(NC2=O)C(=O)NCC3=CC4=C(C=C3)OCC(=O)N4)C(C)C5=CC=CC=C5

InChI

InChI=1S/C25H22N4O4S/c1-13(16-6-4-3-5-7-16)20-14(2)34-25-21(20)23(31)28-22(29-25)24(32)26-11-15-8-9-18-17(10-15)27-19(30)12-33-18/h3-10,13H,11-12H2,1-2H3,(H,26,32)(H,27,30)(H,28,29,31)