2-methylsulfanyl-N-phenethyl-9-(2H-pyran-2-yl)-1,2,3,4-tetrahydropurin-6-amine

Systemtic Name: 2-methylsulfanyl-N-phenethyl-9-(2H-pyran-2-yl)-1,2,3,4-tetrahydropurin-6-amine Openeye Name: 2-methylsulfanyl-N-phenethyl-9-(2H-pyran-2-yl)-1,2,3,4-tetrahydropurin-6-amine CAS Name: 2-(methylthio)-N-phenethyl-9-(2H-pyran-2-yl)-1,2,3,4-tetrahydropurin-6-amine IUPAC Name: 2-methylsulfanyl-N-phenethyl-9-(2H-pyran-2-yl)-1,2,3,4-tetrahydropurin-6-amine Traditional Name: [2-(methylthio)-9-(2H-pyran-2-yl)-1,2,3,4-tetrahydropurin-6-yl]-phenethyl-amine Formula: C19H23N5OS MolecularWeight: 369.48382

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Descriptors Computed from Structure

Canonical SMILES:

CSC1NC2C(=C(N1)NCCC3=CC=CC=C3)N=CN2C4C=CC=CO4

Isomeric SMILES

CSC1NC2C(=C(N1)NCCC3=CC=CC=C3)N=CN2C4C=CC=CO4

InChI

InChI=1S/C19H23N5OS/c1-26-19-22-17(20-11-10-14-7-3-2-4-8-14)16-18(23-19)24(13-21-16)15-9-5-6-12-25-15/h2-9,12-13,15,18-20,22-23H,10-11H2,1H3