(E)-3-(5-bromanylthiophen-2-yl)-N-[(2S)-2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl]prop-2-enamide

Systemtic Name: (E)-3-(5-bromanylthiophen-2-yl)-N-[(2S)-2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl]prop-2-enamide Openeye Name: (E)-3-(5-bromo-2-thienyl)-N-[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]prop-2-enamide CAS Name: (E)-3-(5-bromo-2-thiophenyl)-N-[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]-2-propenamide IUPAC Name: (E)-3-(5-bromothiophen-2-yl)-N-[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]prop-2-enamide Traditional Name: (E)-3-(5-bromo-2-thienyl)-N-[(2S)-3-keto-2-methyl-4H-1,4-benzoxazin-6-yl]acrylamide Formula: C16H13BrN2O3S MolecularWeight: 393.25502

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)C=CC3=CC=C(S3)Br

Isomeric SMILES

C[C@H]1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)/C=C/C3=CC=C(S3)Br

InChI

InChI=1S/C16H13BrN2O3S/c1-9-16(21)19-12-8-10(2-5-13(12)22-9)18-15(20)7-4-11-3-6-14(17)23-11/h2-9H,1H3,(H,18,20)(H,19,21)/b7-4+/t9-/m0/s1