N-(4-chlorophenyl)-6-methyl-2-phenyl-5-[(prop-2-enylamino)methyl]pyrimidin-4-amine

Systemtic Name: N-(4-chlorophenyl)-6-methyl-2-phenyl-5-[(prop-2-enylamino)methyl]pyrimidin-4-amine Openeye Name: 5-[(allylamino)methyl]-N-(4-chlorophenyl)-6-methyl-2-phenyl-pyrimidin-4-amine CAS Name: N-(4-chlorophenyl)-6-methyl-2-phenyl-5-[(prop-2-enylamino)methyl]-4-pyrimidinamine IUPAC Name: N-(4-chlorophenyl)-6-methyl-2-phenyl-5-[(prop-2-enylamino)methyl]pyrimidin-4-amine Traditional Name: allyl-[[4-(4-chloroanilino)-6-methyl-2-phenyl-pyrimidin-5-yl]methyl]amine Formula: C21H21ClN4 MolecularWeight: 364.87124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2=CC=CC=C2)NC3=CC=C(C=C3)Cl)CNCC=C

Isomeric SMILES

CC1=C(C(=NC(=N1)C2=CC=CC=C2)NC3=CC=C(C=C3)Cl)CNCC=C

InChI

InChI=1S/C21H21ClN4/c1-3-13-23-14-19-15(2)24-20(16-7-5-4-6-8-16)26-21(19)25-18-11-9-17(22)10-12-18/h3-12,23H,1,13-14H2,2H3,(H,24,25,26)