N-(4-bromanyl-2-methyl-phenyl)-2-[2-[methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]amino]ethanoylamino]ethanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-[2-[methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]amino]ethanoylamino]ethanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-[[2-[methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]acetyl]amino]acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[[2-[methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]-1-oxoethyl]amino]acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-[[2-[methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]acetyl]amino]acetamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-[[2-[(4-keto-1H-quinazolin-2-yl)methyl-methyl-amino]acetyl]amino]acetamide Formula: C21H22BrN5O3 MolecularWeight: 472.33508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)CN(C)CC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)CN(C)CC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C21H22BrN5O3/c1-13-9-14(22)7-8-16(13)25-19(28)10-23-20(29)12-27(2)11-18-24-17-6-4-3-5-15(17)21(30)26-18/h3-9H,10-12H2,1-2H3,(H,23,29)(H,25,28)(H,24,26,30)