N-[3-[[6-[(3-methylphenyl)amino]pyrimidin-4-yl]amino]phenyl]prop-2-enamide

Systemtic Name: N-[3-[[6-[(3-methylphenyl)amino]pyrimidin-4-yl]amino]phenyl]prop-2-enamide Openeye Name: N-[3-[[6-(3-methylanilino)pyrimidin-4-yl]amino]phenyl]prop-2-enamide CAS Name: N-[3-[[6-(3-methylanilino)-4-pyrimidinyl]amino]phenyl]-2-propenamide IUPAC Name: N-[3-[[6-(3-methylanilino)pyrimidin-4-yl]amino]phenyl]prop-2-enamide Traditional Name: N-[3-[[6-(m-toluidino)pyrimidin-4-yl]amino]phenyl]acrylamide Formula: C20H19N5O MolecularWeight: 345.39776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=CC(=NC=N2)NC3=CC(=CC=C3)NC(=O)C=C

Isomeric SMILES

CC1=CC(=CC=C1)NC2=CC(=NC=N2)NC3=CC(=CC=C3)NC(=O)C=C

InChI

InChI=1S/C20H19N5O/c1-3-20(26)25-17-9-5-8-16(11-17)24-19-12-18(21-13-22-19)23-15-7-4-6-14(2)10-15/h3-13H,1H2,2H3,(H,25,26)(H2,21,22,23,24)