N'-[6-(2-tert-butylsulfanylcarbothioylsulfanylethanoyl)-3-methyl-4-oxidanylidene-pteridin-2-yl]-N,N-dimethyl-methanimidamide

Systemtic Name: N'-[6-(2-tert-butylsulfanylcarbothioylsulfanylethanoyl)-3-methyl-4-oxidanylidene-pteridin-2-yl]-N,N-dimethyl-methanimidamide Openeye Name: N'-[6-(2-tert-butylsulfanylcarbothioylsulfanylacetyl)-3-methyl-4-oxo-pteridin-2-yl]-N,N-dimethyl-formamidine CAS Name: N'-[6-[2-[[(tert-butylthio)-sulfanylidenemethyl]thio]-1-oxoethyl]-3-methyl-4-oxo-2-pteridinyl]-N,N-dimethylmethanimidamide IUPAC Name: N'-[6-(2-tert-butylsulfanylcarbothioylsulfanylacetyl)-3-methyl-4-oxopteridin-2-yl]-N,N-dimethylmethanimidamide Traditional Name: N'-[6-[2-[(tert-butylthio)carbothioylthio]acetyl]-4-keto-3-methyl-pteridin-2-yl]-N,N-dimethyl-formamidine Formula: C17H22N6O2S3 MolecularWeight: 438.59058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SC(=S)SCC(=O)C1=CN=C2C(=N1)C(=O)N(C(=N2)N=CN(C)C)C

Isomeric SMILES

CC(C)(C)SC(=S)SCC(=O)C1=CN=C2C(=N1)C(=O)N(C(=N2)/N=C/N(C)C)C

InChI

InChI=1S/C17H22N6O2S3/c1-17(2,3)28-16(26)27-8-11(24)10-7-18-13-12(20-10)14(25)23(6)15(21-13)19-9-22(4)5/h7,9H,8H2,1-6H3/b19-9+