(2S)-4-(6-phenylthieno[2,3-d]pyrimidin-4-yl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: (2S)-4-(6-phenylthieno[2,3-d]pyrimidin-4-yl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: (2S)-4-(6-phenylthieno[2,3-d]pyrimidin-4-yl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: (2S)-4-(6-phenyl-4-thieno[2,3-d]pyrimidinyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: (2S)-4-(6-phenylthieno[2,3-d]pyrimidin-4-yl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: (2S)-4-(6-phenylthieno[2,3-d]pyrimidin-4-yl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C21H16N4O2S MolecularWeight: 388.44234

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2N1C3=C4C=C(SC4=NC=N3)C5=CC=CC=C5)C(=O)N

Isomeric SMILES

C1[C@H](OC2=CC=CC=C2N1C3=C4C=C(SC4=NC=N3)C5=CC=CC=C5)C(=O)N

InChI

InChI=1S/C21H16N4O2S/c22-19(26)17-11-25(15-8-4-5-9-16(15)27-17)20-14-10-18(13-6-2-1-3-7-13)28-21(14)24-12-23-20/h1-10,12,17H,11H2,(H2,22,26)/t17-/m0/s1