N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-3-(4-oxidanylidenequinazolin-3-yl)propanamide

Systemtic Name: N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-3-(4-oxidanylidenequinazolin-3-yl)propanamide Openeye Name: N-[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-N-methyl-3-(4-oxoquinazolin-3-yl)propanamide CAS Name: N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-N-methyl-3-(4-oxo-3-quinazolinyl)propanamide IUPAC Name: N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-N-methyl-3-(4-oxoquinazolin-3-yl)propanamide Traditional Name: N-[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-3-(4-ketoquinazolin-3-yl)-N-methyl-propionamide Formula: C21H21BrN4O3 MolecularWeight: 457.32044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CN(C)C(=O)CCN2C=NC3=CC=CC=C3C2=O

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CN(C)C(=O)CCN2C=NC3=CC=CC=C3C2=O

InChI

InChI=1S/C21H21BrN4O3/c1-14-11-15(22)7-8-17(14)24-19(27)12-25(2)20(28)9-10-26-13-23-18-6-4-3-5-16(18)21(26)29/h3-8,11,13H,9-10,12H2,1-2H3,(H,24,27)