4-[(2Z)-2-[6-(thiophen-2-ylmethylsulfanyl)purin-8-ylidene]hydrazinyl]benzenesulfonamide

Systemtic Name: 4-[(2Z)-2-[6-(thiophen-2-ylmethylsulfanyl)purin-8-ylidene]hydrazinyl]benzenesulfonamide Openeye Name: 4-[(2Z)-2-[6-(2-thienylmethylsulfanyl)purin-8-ylidene]hydrazino]benzenesulfonamide CAS Name: 4-[(2Z)-2-[6-(thiophen-2-ylmethylthio)-8-purinylidene]hydrazinyl]benzenesulfonamide IUPAC Name: 4-[(2Z)-2-[6-(thiophen-2-ylmethylsulfanyl)purin-8-ylidene]hydrazinyl]benzenesulfonamide Traditional Name: 4-[(N'Z)-N'-[6-(2-thenylthio)purin-8-ylidene]hydrazino]benzenesulfonamide Formula: C16H13N7O2S3 MolecularWeight: 431.51512

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CSC2=NC=NC3=NC(=NNC4=CC=C(C=C4)S(=O)(=O)N)N=C32

Isomeric SMILES

C1=CSC(=C1)CSC2=NC=NC3=N/C(=N\NC4=CC=C(C=C4)S(=O)(=O)N)/N=C32

InChI

InChI=1S/C16H13N7O2S3/c17-28(24,25)12-5-3-10(4-6-12)22-23-16-20-13-14(21-16)18-9-19-15(13)27-8-11-2-1-7-26-11/h1-7,9,22H,8H2,(H2,17,24,25)/b23-16-