N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-4-methyl-3-pyrrol-1-yl-benzamide

Systemtic Name: N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-4-methyl-3-pyrrol-1-yl-benzamide Openeye Name: N-[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-4-methyl-3-pyrrol-1-yl-benzamide CAS Name: N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-4-methyl-3-(1-pyrrolyl)benzamide IUPAC Name: N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-4-methyl-3-pyrrol-1-ylbenzamide Traditional Name: N-[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-4-methyl-3-pyrrol-1-yl-benzamide Formula: C21H20BrN3O2 MolecularWeight: 426.3064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC(=O)NC2=C(C=C(C=C2)Br)C)N3C=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC(=O)NC2=C(C=C(C=C2)Br)C)N3C=CC=C3

InChI

InChI=1S/C21H20BrN3O2/c1-14-5-6-16(12-19(14)25-9-3-4-10-25)21(27)23-13-20(26)24-18-8-7-17(22)11-15(18)2/h3-12H,13H2,1-2H3,(H,23,27)(H,24,26)