2-[(2S)-4-bromanyl-3-[(4-methylphenyl)amino]-5-oxidanylidene-2H-furan-2-yl]propanediamide

Systemtic Name: 2-[(2S)-4-bromanyl-3-[(4-methylphenyl)amino]-5-oxidanylidene-2H-furan-2-yl]propanediamide Openeye Name: 2-[(2S)-4-bromo-3-(4-methylanilino)-5-oxo-2H-furan-2-yl]propanediamide CAS Name: 2-[(2S)-4-bromo-3-(4-methylanilino)-5-oxo-2H-furan-2-yl]propanediamide IUPAC Name: 2-[(2S)-4-bromo-3-(4-methylanilino)-5-oxo-2H-furan-2-yl]propanediamide Traditional Name: 2-[(2S)-4-bromo-5-keto-3-(p-toluidino)-2H-furan-2-yl]malonamide Formula: C14H14BrN3O4 MolecularWeight: 368.18266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=C(C(=O)OC2C(C(=O)N)C(=O)N)Br

Isomeric SMILES

CC1=CC=C(C=C1)NC2=C(C(=O)O[C@H]2C(C(=O)N)C(=O)N)Br

InChI

InChI=1S/C14H14BrN3O4/c1-6-2-4-7(5-3-6)18-10-9(15)14(21)22-11(10)8(12(16)19)13(17)20/h2-5,8,11,18H,1H3,(H2,16,19)(H2,17,20)/t11-/m0/s1