Chemical Component Summary

Name2-[4-(3,6,6-trimethyl-4-oxidanylidene-5,7-dihydro-2~{H}-isoindol-1-yl)-1,3-thiazol-2-yl]guanidine
Identifiers2-[4-(3,6,6-trimethyl-4-oxidanylidene-5,7-dihydro-2~{H}-isoindol-1-yl)-1,3-thiazol-2-yl]guanidine
FormulaC15 H19 N5 O S
Molecular Weight317.409
TypeNON-POLYMER
Isomeric SMILESCc1c2c(c([nH]1)c3csc(n3)N=C(N)N)CC(CC2=O)(C)C
InChIInChI=1S/C15H19N5OS/c1-7-11-8(4-15(2,3)5-10(11)21)12(18-7)9-6-22-14(19-9)20-13(16)17/h6,18H,4-5H2,1-3H3,(H4,16,17,19,20)
InChIKeyDRJITSMHAYLRJA-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count41
Chiral Atom Count0
Bond Count43
Aromatic Bond Count10

Related Resource References

Resource NameReference
PubChem 168297927
ChEMBL CHEMBL5207551