4-[[[2-[(4-bromanyl-3-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-cyclopropyl-amino]methyl]benzamide

Systemtic Name: 4-[[[2-[(4-bromanyl-3-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-cyclopropyl-amino]methyl]benzamide Openeye Name: 4-[[[2-(4-bromo-3-methyl-anilino)-2-oxo-ethyl]-cyclopropyl-amino]methyl]benzamide CAS Name: 4-[[[2-(4-bromo-3-methylanilino)-2-oxoethyl]-cyclopropylamino]methyl]benzamide IUPAC Name: 4-[[[2-(4-bromo-3-methylanilino)-2-oxoethyl]-cyclopropylamino]methyl]benzamide Traditional Name: 4-[[[2-(4-bromo-3-methyl-anilino)-2-keto-ethyl]-cyclopropyl-amino]methyl]benzamide Formula: C20H22BrN3O2 MolecularWeight: 416.31158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CN(CC2=CC=C(C=C2)C(=O)N)C3CC3)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CN(CC2=CC=C(C=C2)C(=O)N)C3CC3)Br

InChI

InChI=1S/C20H22BrN3O2/c1-13-10-16(6-9-18(13)21)23-19(25)12-24(17-7-8-17)11-14-2-4-15(5-3-14)20(22)26/h2-6,9-10,17H,7-8,11-12H2,1H3,(H2,22,26)(H,23,25)