N-(2-chloroethyl)-8-sulfanylidene-9H-purine-7-carboxamide

Systemtic Name: N-(2-chloroethyl)-8-sulfanylidene-9H-purine-7-carboxamide Openeye Name: N-(2-chloroethyl)-8-thioxo-9H-purine-7-carboxamide CAS Name: N-(2-chloroethyl)-8-sulfanylidene-9H-purine-7-carboxamide IUPAC Name: N-(2-chloroethyl)-8-sulfanylidene-9H-purine-7-carboxamide Traditional Name: N-(2-chloroethyl)-8-thioxo-9H-purine-7-carboxamide Formula: C8H8ClN5OS MolecularWeight: 257.70002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C2C(=NC=N1)NC(=S)N2C(=O)NCCCl

Isomeric SMILES

C1=C2C(=NC=N1)NC(=S)N2C(=O)NCCCl

InChI

InChI=1S/C8H8ClN5OS/c9-1-2-11-7(15)14-5-3-10-4-12-6(5)13-8(14)16/h3-4H,1-2H2,(H,11,15)(H,10,12,13,16)