(2S)-4-(2-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: (2S)-4-(2-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: (2S)-4-(2-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: (2S)-4-(2-methyl-5-phenyl-4-thieno[2,3-d]pyrimidinyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: (2S)-4-(2-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: (2S)-4-(2-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C22H18N4O2S MolecularWeight: 402.46892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C2C(=CSC2=N1)C3=CC=CC=C3)N4CC(OC5=CC=CC=C54)C(=O)N

Isomeric SMILES

CC1=NC(=C2C(=CSC2=N1)C3=CC=CC=C3)N4C[C@H](OC5=CC=CC=C54)C(=O)N

InChI

InChI=1S/C22H18N4O2S/c1-13-24-21(19-15(12-29-22(19)25-13)14-7-3-2-4-8-14)26-11-18(20(23)27)28-17-10-6-5-9-16(17)26/h2-10,12,18H,11H2,1H3,(H2,23,27)/t18-/m0/s1