N-[4-[[5-azanyl-6-[(4-butylphenyl)amino]pyrimidin-4-yl]amino]phenyl]ethanamide

Systemtic Name: N-[4-[[5-azanyl-6-[(4-butylphenyl)amino]pyrimidin-4-yl]amino]phenyl]ethanamide Openeye Name: N-[4-[[5-amino-6-(4-butylanilino)pyrimidin-4-yl]amino]phenyl]acetamide CAS Name: N-[4-[[5-amino-6-(4-butylanilino)-4-pyrimidinyl]amino]phenyl]acetamide IUPAC Name: N-[4-[[5-amino-6-(4-butylanilino)pyrimidin-4-yl]amino]phenyl]acetamide Traditional Name: N-[4-[[5-amino-6-(4-butylanilino)pyrimidin-4-yl]amino]phenyl]acetamide Formula: C22H26N6O MolecularWeight: 390.48144

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC2=C(C(=NC=N2)NC3=CC=C(C=C3)NC(=O)C)N

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC2=C(C(=NC=N2)NC3=CC=C(C=C3)NC(=O)C)N

InChI

InChI=1S/C22H26N6O/c1-3-4-5-16-6-8-18(9-7-16)27-21-20(23)22(25-14-24-21)28-19-12-10-17(11-13-19)26-15(2)29/h6-14H,3-5,23H2,1-2H3,(H,26,29)(H2,24,25,27,28)