2-[6-[[(3S)-1-(5-methylsulfanylpyridin-2-yl)pyrrolidin-3-yl]amino]purin-9-yl]oxolane-3,4-diol

Systemtic Name: 2-[6-[[(3S)-1-(5-methylsulfanylpyridin-2-yl)pyrrolidin-3-yl]amino]purin-9-yl]oxolane-3,4-diol Openeye Name: 2-[6-[[(3S)-1-(5-methylsulfanyl-2-pyridyl)pyrrolidin-3-yl]amino]purin-9-yl]tetrahydrofuran-3,4-diol CAS Name: 2-[6-[[(3S)-1-[5-(methylthio)-2-pyridinyl]-3-pyrrolidinyl]amino]-9-purinyl]oxolane-3,4-diol IUPAC Name: 2-[6-[[(3S)-1-(5-methylsulfanylpyridin-2-yl)pyrrolidin-3-yl]amino]purin-9-yl]oxolane-3,4-diol Traditional Name: 2-[6-[[(3S)-1-[5-(methylthio)-2-pyridyl]pyrrolidin-3-yl]amino]purin-9-yl]tetrahydrofuran-3,4-diol Formula: C19H23N7O3S MolecularWeight: 429.49602

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CN=C(C=C1)N2CCC(C2)NC3=NC=NC4=C3N=CN4C5C(C(CO5)O)O

Isomeric SMILES

CSC1=CN=C(C=C1)N2CC[C@@H](C2)NC3=NC=NC4=C3N=CN4C5C(C(CO5)O)O

InChI

InChI=1S/C19H23N7O3S/c1-30-12-2-3-14(20-6-12)25-5-4-11(7-25)24-17-15-18(22-9-21-17)26(10-23-15)19-16(28)13(27)8-29-19/h2-3,6,9-11,13,16,19,27-28H,4-5,7-8H2,1H3,(H,21,22,24)/t11-,13?,16?,19?/m0/s1