2-azanyl-8-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-3,7-dihydropurin-6-one

Systemtic Name: 2-azanyl-8-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-3,7-dihydropurin-6-one Openeye Name: 2-amino-8-[2-(2-methylindolin-1-yl)-2-oxo-ethyl]sulfanyl-3,7-dihydropurin-6-one CAS Name: 2-amino-8-[[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]thio]-3,7-dihydropurin-6-one IUPAC Name: 2-amino-8-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]sulfanyl-3,7-dihydropurin-6-one Traditional Name: 2-amino-8-[[2-keto-2-(2-methylindolin-1-yl)ethyl]thio]-3,7-dihydropurin-6-one Formula: C16H16N6O2S MolecularWeight: 356.40224

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C(=O)CSC3=NC4=C(N3)C(=O)N=C(N4)N

Isomeric SMILES

CC1CC2=CC=CC=C2N1C(=O)CSC3=NC4=C(N3)C(=O)N=C(N4)N

InChI

InChI=1S/C16H16N6O2S/c1-8-6-9-4-2-3-5-10(9)22(8)11(23)7-25-16-18-12-13(20-16)19-15(17)21-14(12)24/h2-5,8H,6-7H2,1H3,(H4,17,18,19,20,21,24)