2-methyl-6-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]-4H-1,4-benzoxazin-3-one

Systemtic Name: 2-methyl-6-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]-4H-1,4-benzoxazin-3-one Openeye Name: 2-methyl-6-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]-4H-1,4-benzoxazin-3-one CAS Name: 2-methyl-6-[(5-phenyl-4-thieno[2,3-d]pyrimidinyl)amino]-4H-1,4-benzoxazin-3-one IUPAC Name: 2-methyl-6-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]-4H-1,4-benzoxazin-3-one Traditional Name: 2-methyl-6-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]-4H-1,4-benzoxazin-3-one Formula: C21H16N4O2S MolecularWeight: 388.44234

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC2=C(O1)C=CC(=C2)NC3=C4C(=CSC4=NC=N3)C5=CC=CC=C5

Isomeric SMILES

CC1C(=O)NC2=C(O1)C=CC(=C2)NC3=C4C(=CSC4=NC=N3)C5=CC=CC=C5

InChI

InChI=1S/C21H16N4O2S/c1-12-20(26)25-16-9-14(7-8-17(16)27-12)24-19-18-15(13-5-3-2-4-6-13)10-28-21(18)23-11-22-19/h2-12H,1H3,(H,25,26)(H,22,23,24)