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

Systemtic Name: N-[4-[(3-cyclopentyloxy-4-methoxy-phenyl)methylamino]-6-methyl-2-methylsulfanyl-pyrimidin-5-yl]propanamide Openeye Name: N-[4-[[3-(cyclopentoxy)-4-methoxy-phenyl]methylamino]-6-methyl-2-methylsulfanyl-pyrimidin-5-yl]propanamide CAS Name: N-[4-[(3-cyclopentyloxy-4-methoxyphenyl)methylamino]-6-methyl-2-(methylthio)-5-pyrimidinyl]propanamide IUPAC Name: N-[4-[(3-cyclopentyloxy-4-methoxyphenyl)methylamino]-6-methyl-2-methylsulfanylpyrimidin-5-yl]propanamide Traditional Name: N-[4-[[3-(cyclopentoxy)-4-methoxy-benzyl]amino]-6-methyl-2-(methylthio)pyrimidin-5-yl]propionamide Formula: C22H30N4O3S MolecularWeight: 430.5636

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(N=C(N=C1NCC2=CC(=C(C=C2)OC)OC3CCCC3)SC)C

Isomeric SMILES

CCC(=O)NC1=C(N=C(N=C1NCC2=CC(=C(C=C2)OC)OC3CCCC3)SC)C

InChI

InChI=1S/C22H30N4O3S/c1-5-19(27)25-20-14(2)24-22(30-4)26-21(20)23-13-15-10-11-17(28-3)18(12-15)29-16-8-6-7-9-16/h10-12,16H,5-9,13H2,1-4H3,(H,25,27)(H,23,24,26)