N-(6-methyl-1,3-benzothiazol-2-yl)-2-(7H-purin-6-ylsulfanyl)ethanamide

Systemtic Name: N-(6-methyl-1,3-benzothiazol-2-yl)-2-(7H-purin-6-ylsulfanyl)ethanamide Openeye Name: N-(6-methyl-1,3-benzothiazol-2-yl)-2-(7H-purin-6-ylsulfanyl)acetamide CAS Name: N-(6-methyl-1,3-benzothiazol-2-yl)-2-(7H-purin-6-ylthio)acetamide IUPAC Name: N-(6-methyl-1,3-benzothiazol-2-yl)-2-(7H-purin-6-ylsulfanyl)acetamide Traditional Name: N-(6-methyl-1,3-benzothiazol-2-yl)-2-(7H-purin-6-ylthio)acetamide Formula: C15H12N6OS2 MolecularWeight: 356.42538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=NC=NC4=C3NC=N4

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=NC=NC4=C3NC=N4

InChI

InChI=1S/C15H12N6OS2/c1-8-2-3-9-10(4-8)24-15(20-9)21-11(22)5-23-14-12-13(17-6-16-12)18-7-19-14/h2-4,6-7H,5H2,1H3,(H,20,21,22)(H,16,17,18,19)