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

Systemtic Name: 6-(3-azanyl-3-oxidanylidene-propyl)-5-methyl-4-oxidanylidene-N-[(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)methyl]-3H-thieno[2,3-d]pyrimidine-2-carboxamide Openeye Name: 6-(3-amino-3-oxo-propyl)-5-methyl-4-oxo-N-[(3-oxo-4H-1,4-benzoxazin-6-yl)methyl]-3H-thieno[2,3-d]pyrimidine-2-carboxamide CAS Name: 6-(3-amino-3-oxopropyl)-5-methyl-4-oxo-N-[(3-oxo-4H-1,4-benzoxazin-6-yl)methyl]-3H-thieno[2,3-d]pyrimidine-2-carboxamide IUPAC Name: 6-(3-amino-3-oxopropyl)-5-methyl-4-oxo-N-[(3-oxo-4H-1,4-benzoxazin-6-yl)methyl]-3H-thieno[2,3-d]pyrimidine-2-carboxamide Traditional Name: 6-(3-amino-3-keto-propyl)-4-keto-N-[(3-keto-4H-1,4-benzoxazin-6-yl)methyl]-5-methyl-3H-thieno[2,3-d]pyrimidine-2-carboxamide Formula: C20H19N5O5S MolecularWeight: 441.46036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)C(=O)NCC3=CC4=C(C=C3)OCC(=O)N4)CCC(=O)N

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)C(=O)NCC3=CC4=C(C=C3)OCC(=O)N4)CCC(=O)N

InChI

InChI=1S/C20H19N5O5S/c1-9-13(4-5-14(21)26)31-20-16(9)18(28)24-17(25-20)19(29)22-7-10-2-3-12-11(6-10)23-15(27)8-30-12/h2-3,6H,4-5,7-8H2,1H3,(H2,21,26)(H,22,29)(H,23,27)(H,24,25,28)