3-[(3-cyclopentyloxy-4-methoxy-phenyl)methyl]-8-[1-(thiophen-3-ylmethoxy)propan-2-yl]purin-6-amine

Systemtic Name: 3-[(3-cyclopentyloxy-4-methoxy-phenyl)methyl]-8-[1-(thiophen-3-ylmethoxy)propan-2-yl]purin-6-amine Openeye Name: 3-[[3-(cyclopentoxy)-4-methoxy-phenyl]methyl]-8-[1-methyl-2-(3-thienylmethoxy)ethyl]purin-6-amine CAS Name: 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-8-[1-(3-thiophenylmethoxy)propan-2-yl]-6-purinamine IUPAC Name: 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-8-[1-(thiophen-3-ylmethoxy)propan-2-yl]purin-6-amine Traditional Name: [3-[3-(cyclopentoxy)-4-methoxy-benzyl]-8-[1-methyl-2-(3-thenyloxy)ethyl]purin-6-yl]amine Formula: C26H31N5O3S MolecularWeight: 493.62104

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Descriptors Computed from Structure

Canonical SMILES:

CC(COCC1=CSC=C1)C2=NC3=C(N=CN(C3=N2)CC4=CC(=C(C=C4)OC)OC5CCCC5)N

Isomeric SMILES

CC(COCC1=CSC=C1)C2=NC3=C(N=CN(C3=N2)CC4=CC(=C(C=C4)OC)OC5CCCC5)N

InChI

InChI=1S/C26H31N5O3S/c1-17(13-33-14-19-9-10-35-15-19)25-29-23-24(27)28-16-31(26(23)30-25)12-18-7-8-21(32-2)22(11-18)34-20-5-3-4-6-20/h7-11,15-17,20H,3-6,12-14,27H2,1-2H3