N-[(2S)-1-[[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-amino]-1-oxidanylidene-propan-2-yl]furan-2-carboxamide

Systemtic Name: N-[(2S)-1-[[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-amino]-1-oxidanylidene-propan-2-yl]furan-2-carboxamide Openeye Name: N-[(1S)-2-[[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-methyl-amino]-1-methyl-2-oxo-ethyl]furan-2-carboxamide CAS Name: N-[(2S)-1-[[2-(4-bromo-2-methylanilino)-2-oxoethyl]-methylamino]-1-oxopropan-2-yl]-2-furancarboxamide IUPAC Name: N-[(2S)-1-[[2-(4-bromo-2-methylanilino)-2-oxoethyl]-methylamino]-1-oxopropan-2-yl]furan-2-carboxamide Traditional Name: N-[(1S)-2-[[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-methyl-amino]-2-keto-1-methyl-ethyl]-2-furamide Formula: C18H20BrN3O4 MolecularWeight: 422.2731

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CN(C)C(=O)C(C)NC(=O)C2=CC=CO2

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CN(C)C(=O)[C@H](C)NC(=O)C2=CC=CO2

InChI

InChI=1S/C18H20BrN3O4/c1-11-9-13(19)6-7-14(11)21-16(23)10-22(3)18(25)12(2)20-17(24)15-5-4-8-26-15/h4-9,12H,10H2,1-3H3,(H,20,24)(H,21,23)/t12-/m0/s1