N-[2-[(6-sulfanylidene-3H-purin-9-yl)sulfonylamino]phenyl]ethanamide

Systemtic Name: N-[2-[(6-sulfanylidene-3H-purin-9-yl)sulfonylamino]phenyl]ethanamide Openeye Name: N-[2-[(6-thioxo-3H-purin-9-yl)sulfonylamino]phenyl]acetamide CAS Name: N-[2-[(6-sulfanylidene-3H-purin-9-yl)sulfonylamino]phenyl]acetamide IUPAC Name: N-[2-[(6-sulfanylidene-3H-purin-9-yl)sulfonylamino]phenyl]acetamide Traditional Name: N-[2-[(6-thioxo-3H-purin-9-yl)sulfonylamino]phenyl]acetamide Formula: C13H12N6O3S2 MolecularWeight: 364.40278

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC=C1NS(=O)(=O)N2C=NC3=C2NC=NC3=S

Isomeric SMILES

CC(=O)NC1=CC=CC=C1NS(=O)(=O)N2C=NC3=C2NC=NC3=S

InChI

InChI=1S/C13H12N6O3S2/c1-8(20)17-9-4-2-3-5-10(9)18-24(21,22)19-7-16-11-12(19)14-6-15-13(11)23/h2-7,18H,1H3,(H,17,20)(H,14,15,23)