1-[4-[[5-methyl-4-(prop-2-ynylamino)pyrimidin-2-yl]amino]phenyl]ethanone

Systemtic Name: 1-[4-[[5-methyl-4-(prop-2-ynylamino)pyrimidin-2-yl]amino]phenyl]ethanone Openeye Name: 1-[4-[[5-methyl-4-(prop-2-ynylamino)pyrimidin-2-yl]amino]phenyl]ethanone CAS Name: 1-[4-[[5-methyl-4-(prop-2-ynylamino)-2-pyrimidinyl]amino]phenyl]ethanone IUPAC Name: 1-[4-[[5-methyl-4-(prop-2-ynylamino)pyrimidin-2-yl]amino]phenyl]ethanone Traditional Name: 1-[4-[[5-methyl-4-(propargylamino)pyrimidin-2-yl]amino]phenyl]ethanone Formula: C16H16N4O MolecularWeight: 280.32444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N=C1NCC#C)NC2=CC=C(C=C2)C(=O)C

Isomeric SMILES

CC1=CN=C(N=C1NCC#C)NC2=CC=C(C=C2)C(=O)C

InChI

InChI=1S/C16H16N4O/c1-4-9-17-15-11(2)10-18-16(20-15)19-14-7-5-13(6-8-14)12(3)21/h1,5-8,10H,9H2,2-3H3,(H2,17,18,19,20)