(4R,5S)-9-quinolin-8-ylsulfonyl-3,4,5,7-tetrahydropurine-2,6,8-trione

Systemtic Name: (4R,5S)-9-quinolin-8-ylsulfonyl-3,4,5,7-tetrahydropurine-2,6,8-trione Openeye Name: (4R,5S)-9-(8-quinolylsulfonyl)-3,4,5,7-tetrahydropurine-2,6,8-trione CAS Name: (4R,5S)-9-(8-quinolinylsulfonyl)-3,4,5,7-tetrahydropurine-2,6,8-trione IUPAC Name: (4R,5S)-9-quinolin-8-ylsulfonyl-3,4,5,7-tetrahydropurine-2,6,8-trione Traditional Name: (4R,5S)-9-(8-quinolylsulfonyl)-3,4,5,7-tetrahydropurine-2,6,8-trione Formula: C14H11N5O5S MolecularWeight: 361.33264

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)S(=O)(=O)N3C4C(C(=O)NC(=O)N4)NC3=O)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)S(=O)(=O)N3[C@@H]4[C@@H](C(=O)NC(=O)N4)NC3=O)N=CC=C2

InChI

InChI=1S/C14H11N5O5S/c20-12-10-11(17-13(21)18-12)19(14(22)16-10)25(23,24)8-5-1-3-7-4-2-6-15-9(7)8/h1-6,10-11H,(H,16,22)(H2,17,18,20,21)/t10-,11+/m0/s1