N-(4-bromanyl-2-methyl-phenyl)-2-[[2-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)-2-oxidanylidene-ethyl]-methyl-amino]ethanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-[[2-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)-2-oxidanylidene-ethyl]-methyl-amino]ethanamide Openeye Name: 2-[[2-(1-allyl-2,5-dimethyl-pyrrol-3-yl)-2-oxo-ethyl]-methyl-amino]-N-(4-bromo-2-methyl-phenyl)acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[[2-(2,5-dimethyl-1-prop-2-enyl-3-pyrrolyl)-2-oxoethyl]-methylamino]acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-[[2-(2,5-dimethyl-1-prop-2-enylpyrrol-3-yl)-2-oxoethyl]-methylamino]acetamide Traditional Name: 2-[[2-(1-allyl-2,5-dimethyl-pyrrol-3-yl)-2-keto-ethyl]-methyl-amino]-N-(4-bromo-2-methyl-phenyl)acetamide Formula: C21H26BrN3O2 MolecularWeight: 432.35404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC=C)C)C(=O)CN(C)CC(=O)NC2=C(C=C(C=C2)Br)C

Isomeric SMILES

CC1=CC(=C(N1CC=C)C)C(=O)CN(C)CC(=O)NC2=C(C=C(C=C2)Br)C

InChI

InChI=1S/C21H26BrN3O2/c1-6-9-25-15(3)11-18(16(25)4)20(26)12-24(5)13-21(27)23-19-8-7-17(22)10-14(19)2/h6-8,10-11H,1,9,12-13H2,2-5H3,(H,23,27)