(E)-N-[(2S)-2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl]-3-(1-phenylpyrazol-4-yl)prop-2-enamide

Systemtic Name: (E)-N-[(2S)-2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl]-3-(1-phenylpyrazol-4-yl)prop-2-enamide Openeye Name: (E)-N-[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]-3-(1-phenylpyrazol-4-yl)prop-2-enamide CAS Name: (E)-N-[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]-3-(1-phenyl-4-pyrazolyl)-2-propenamide IUPAC Name: (E)-N-[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]-3-(1-phenylpyrazol-4-yl)prop-2-enamide Traditional Name: (E)-N-[(2S)-3-keto-2-methyl-4H-1,4-benzoxazin-6-yl]-3-(1-phenylpyrazol-4-yl)acrylamide Formula: C21H18N4O3 MolecularWeight: 374.39262

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)C=CC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

C[C@H]1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)/C=C/C3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H18N4O3/c1-14-21(27)24-18-11-16(8-9-19(18)28-14)23-20(26)10-7-15-12-22-25(13-15)17-5-3-2-4-6-17/h2-14H,1H3,(H,23,26)(H,24,27)/b10-7+/t14-/m0/s1