N-[4-[(3-cyclopentyloxy-4-methoxy-phenyl)methylamino]-6-methyl-2-methylsulfanyl-pyrimidin-5-yl]ethanamide

Systemtic Name: N-[4-[(3-cyclopentyloxy-4-methoxy-phenyl)methylamino]-6-methyl-2-methylsulfanyl-pyrimidin-5-yl]ethanamide Openeye Name: N-[4-[[3-(cyclopentoxy)-4-methoxy-phenyl]methylamino]-6-methyl-2-methylsulfanyl-pyrimidin-5-yl]acetamide CAS Name: N-[4-[(3-cyclopentyloxy-4-methoxyphenyl)methylamino]-6-methyl-2-(methylthio)-5-pyrimidinyl]acetamide IUPAC Name: N-[4-[(3-cyclopentyloxy-4-methoxyphenyl)methylamino]-6-methyl-2-methylsulfanylpyrimidin-5-yl]acetamide Traditional Name: N-[4-[[3-(cyclopentoxy)-4-methoxy-benzyl]amino]-6-methyl-2-(methylthio)pyrimidin-5-yl]acetamide Formula: C21H28N4O3S MolecularWeight: 416.53702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SC)NCC2=CC(=C(C=C2)OC)OC3CCCC3)NC(=O)C

Isomeric SMILES

CC1=C(C(=NC(=N1)SC)NCC2=CC(=C(C=C2)OC)OC3CCCC3)NC(=O)C

InChI

InChI=1S/C21H28N4O3S/c1-13-19(24-14(2)26)20(25-21(23-13)29-4)22-12-15-9-10-17(27-3)18(11-15)28-16-7-5-6-8-16/h9-11,16H,5-8,12H2,1-4H3,(H,24,26)(H,22,23,25)