N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-4-(5-methylpyrazol-1-yl)benzamide

Systemtic Name: N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-4-(5-methylpyrazol-1-yl)benzamide Openeye Name: N-[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-N-methyl-4-(5-methylpyrazol-1-yl)benzamide CAS Name: N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-N-methyl-4-(5-methyl-1-pyrazolyl)benzamide IUPAC Name: N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-N-methyl-4-(5-methylpyrazol-1-yl)benzamide Traditional Name: N-[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-N-methyl-4-(5-methylpyrazol-1-yl)benzamide Formula: C21H21BrN4O2 MolecularWeight: 441.32104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=NN1C2=CC=C(C=C2)C(=O)N(C)CC(=O)NC3=C(C=C(C=C3)Br)C

Isomeric SMILES

CC1=CC=NN1C2=CC=C(C=C2)C(=O)N(C)CC(=O)NC3=C(C=C(C=C3)Br)C

InChI

InChI=1S/C21H21BrN4O2/c1-14-12-17(22)6-9-19(14)24-20(27)13-25(3)21(28)16-4-7-18(8-5-16)26-15(2)10-11-23-26/h4-12H,13H2,1-3H3,(H,24,27)