1-[4-[(5-methylpyrimidin-4-yl)amino]phenyl]-2-[1-(thiophen-2-ylmethyl)piperidin-4-yl]ethanone

Systemtic Name: 1-[4-[(5-methylpyrimidin-4-yl)amino]phenyl]-2-[1-(thiophen-2-ylmethyl)piperidin-4-yl]ethanone Openeye Name: 1-[4-[(5-methylpyrimidin-4-yl)amino]phenyl]-2-[1-(2-thienylmethyl)-4-piperidyl]ethanone CAS Name: 1-[4-[(5-methyl-4-pyrimidinyl)amino]phenyl]-2-[1-(thiophen-2-ylmethyl)-4-piperidinyl]ethanone IUPAC Name: 1-[4-[(5-methylpyrimidin-4-yl)amino]phenyl]-2-[1-(thiophen-2-ylmethyl)piperidin-4-yl]ethanone Traditional Name: 1-[4-[(5-methylpyrimidin-4-yl)amino]phenyl]-2-[1-(2-thenyl)-4-piperidyl]ethanone Formula: C23H26N4OS MolecularWeight: 406.54374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=CN=C1NC2=CC=C(C=C2)C(=O)CC3CCN(CC3)CC4=CC=CS4

Isomeric SMILES

CC1=CN=CN=C1NC2=CC=C(C=C2)C(=O)CC3CCN(CC3)CC4=CC=CS4

InChI

InChI=1S/C23H26N4OS/c1-17-14-24-16-25-23(17)26-20-6-4-19(5-7-20)22(28)13-18-8-10-27(11-9-18)15-21-3-2-12-29-21/h2-7,12,14,16,18H,8-11,13,15H2,1H3,(H,24,25,26)