N-[3-[[5-methyl-4-[(3-methylphenyl)amino]pyrimidin-2-yl]amino]phenyl]prop-2-enamide

Systemtic Name: N-[3-[[5-methyl-4-[(3-methylphenyl)amino]pyrimidin-2-yl]amino]phenyl]prop-2-enamide Openeye Name: N-[3-[[5-methyl-4-(3-methylanilino)pyrimidin-2-yl]amino]phenyl]prop-2-enamide CAS Name: N-[3-[[5-methyl-4-(3-methylanilino)-2-pyrimidinyl]amino]phenyl]-2-propenamide IUPAC Name: N-[3-[[5-methyl-4-(3-methylanilino)pyrimidin-2-yl]amino]phenyl]prop-2-enamide Traditional Name: N-[3-[[5-methyl-4-(m-toluidino)pyrimidin-2-yl]amino]phenyl]acrylamide Formula: C21H21N5O MolecularWeight: 359.42434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NC(=NC=C2C)NC3=CC(=CC=C3)NC(=O)C=C

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NC(=NC=C2C)NC3=CC(=CC=C3)NC(=O)C=C

InChI

InChI=1S/C21H21N5O/c1-4-19(27)23-17-9-6-10-18(12-17)25-21-22-13-15(3)20(26-21)24-16-8-5-7-14(2)11-16/h4-13H,1H2,2-3H3,(H,23,27)(H2,22,24,25,26)