N-[4-[4-morpholin-4-yl-6-(1H-pyrazol-5-ylamino)pyrimidin-2-yl]sulfanylphenyl]propanamide

Systemtic Name: N-[4-[4-morpholin-4-yl-6-(1H-pyrazol-5-ylamino)pyrimidin-2-yl]sulfanylphenyl]propanamide Openeye Name: N-[4-[4-morpholino-6-(1H-pyrazol-5-ylamino)pyrimidin-2-yl]sulfanylphenyl]propanamide CAS Name: N-[4-[[4-(4-morpholinyl)-6-(1H-pyrazol-5-ylamino)-2-pyrimidinyl]thio]phenyl]propanamide IUPAC Name: N-[4-[4-morpholin-4-yl-6-(1H-pyrazol-5-ylamino)pyrimidin-2-yl]sulfanylphenyl]propanamide Traditional Name: N-[4-[[4-morpholino-6-(1H-pyrazol-5-ylamino)pyrimidin-2-yl]thio]phenyl]propionamide Formula: C20H23N7O2S MolecularWeight: 425.50732

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)SC2=NC(=CC(=N2)NC3=CC=NN3)N4CCOCC4

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)SC2=NC(=CC(=N2)NC3=CC=NN3)N4CCOCC4

InChI

InChI=1S/C20H23N7O2S/c1-2-19(28)22-14-3-5-15(6-4-14)30-20-24-17(23-16-7-8-21-26-16)13-18(25-20)27-9-11-29-12-10-27/h3-8,13H,2,9-12H2,1H3,(H,22,28)(H2,21,23,24,25,26)