N-[4-[4-[(5-methyl-1H-pyrazol-3-yl)amino]-6-(4-pyrrolidin-1-ylpiperidin-1-yl)pyrimidin-2-yl]sulfanylphenyl]propanamide

Systemtic Name: N-[4-[4-[(5-methyl-1H-pyrazol-3-yl)amino]-6-(4-pyrrolidin-1-ylpiperidin-1-yl)pyrimidin-2-yl]sulfanylphenyl]propanamide Openeye Name: N-[4-[4-[(5-methyl-1H-pyrazol-3-yl)amino]-6-(4-pyrrolidin-1-yl-1-piperidyl)pyrimidin-2-yl]sulfanylphenyl]propanamide CAS Name: N-[4-[[4-[(5-methyl-1H-pyrazol-3-yl)amino]-6-[4-(1-pyrrolidinyl)-1-piperidinyl]-2-pyrimidinyl]thio]phenyl]propanamide IUPAC Name: N-[4-[4-[(5-methyl-1H-pyrazol-3-yl)amino]-6-(4-pyrrolidin-1-ylpiperidin-1-yl)pyrimidin-2-yl]sulfanylphenyl]propanamide Traditional Name: N-[4-[[4-[(5-methyl-1H-pyrazol-3-yl)amino]-6-(4-pyrrolidinopiperidino)pyrimidin-2-yl]thio]phenyl]propionamide Formula: C26H34N8OS MolecularWeight: 506.66616

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)SC2=NC(=CC(=N2)NC3=NNC(=C3)C)N4CCC(CC4)N5CCCC5

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)SC2=NC(=CC(=N2)NC3=NNC(=C3)C)N4CCC(CC4)N5CCCC5

InChI

InChI=1S/C26H34N8OS/c1-3-25(35)27-19-6-8-21(9-7-19)36-26-29-22(28-23-16-18(2)31-32-23)17-24(30-26)34-14-10-20(11-15-34)33-12-4-5-13-33/h6-9,16-17,20H,3-5,10-15H2,1-2H3,(H,27,35)(H2,28,29,30,31,32)