4-[(6-sulfanylidene-3H-purin-9-yl)methyl]benzoic acid
Molecular Formula:
C
13
H
10
N
4
O
2
S
InChI:
InChI=1/C13H10N4O2S/c18-13(19)9-3-1-8(2-4-9)5-17-7-16-10-11(17)14-6-15-12(10)20/h1-4,6-7H,5H2,(H,18,19)(H,14,15,20)/f/h14,18H
InChIKey:
InChIKey=SHJUHFMRQUDXAG-VRWLZDFCCI
SMILES:
C1=CC(=CC=C1CN2C=NC3=C2NC=NC3=S)C(=O)O
Names:
NSC73756
17756-30-8
4-[(6-sulfanylidene-3H-purin-9-yl)methyl]benzoic acid
Registries:
PubChem CID 4989154
PubChem ID 115902