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

Systemtic Name: N-[4-[(3-cyclopentyloxy-4-methoxy-phenyl)methylamino]-2-ethylsulfanyl-6-methyl-pyrimidin-5-yl]ethanamide Openeye Name: N-[4-[[3-(cyclopentoxy)-4-methoxy-phenyl]methylamino]-2-ethylsulfanyl-6-methyl-pyrimidin-5-yl]acetamide CAS Name: N-[4-[(3-cyclopentyloxy-4-methoxyphenyl)methylamino]-2-(ethylthio)-6-methyl-5-pyrimidinyl]acetamide IUPAC Name: N-[4-[(3-cyclopentyloxy-4-methoxyphenyl)methylamino]-2-ethylsulfanyl-6-methylpyrimidin-5-yl]acetamide Traditional Name: N-[4-[[3-(cyclopentoxy)-4-methoxy-benzyl]amino]-2-(ethylthio)-6-methyl-pyrimidin-5-yl]acetamide Formula: C22H30N4O3S MolecularWeight: 430.5636

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC(=C(C(=N1)NCC2=CC(=C(C=C2)OC)OC3CCCC3)NC(=O)C)C

Isomeric SMILES

CCSC1=NC(=C(C(=N1)NCC2=CC(=C(C=C2)OC)OC3CCCC3)NC(=O)C)C

InChI

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