N-[4-[(2-methyl-6-piperidin-1-yl-pyrimidin-4-yl)amino]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[4-[(2-methyl-6-piperidin-1-yl-pyrimidin-4-yl)amino]phenyl]thiophene-2-carboxamide Openeye Name: N-[4-[[2-methyl-6-(1-piperidyl)pyrimidin-4-yl]amino]phenyl]thiophene-2-carboxamide CAS Name: N-[4-[[2-methyl-6-(1-piperidinyl)-4-pyrimidinyl]amino]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[(2-methyl-6-piperidin-1-ylpyrimidin-4-yl)amino]phenyl]thiophene-2-carboxamide Traditional Name: N-[4-[(2-methyl-6-piperidino-pyrimidin-4-yl)amino]phenyl]thiophene-2-carboxamide Formula: C21H23N5OS MolecularWeight: 393.50522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)NC2=CC=C(C=C2)NC(=O)C3=CC=CS3)N4CCCCC4

Isomeric SMILES

CC1=NC(=CC(=N1)NC2=CC=C(C=C2)NC(=O)C3=CC=CS3)N4CCCCC4

InChI

InChI=1S/C21H23N5OS/c1-15-22-19(14-20(23-15)26-11-3-2-4-12-26)24-16-7-9-17(10-8-16)25-21(27)18-6-5-13-28-18/h5-10,13-14H,2-4,11-12H2,1H3,(H,25,27)(H,22,23,24)