Chemical Component Summary

Name3-benzyl-2,9-dimethyl-4H,6H-thieno[2,3-e][1,2,4]triazolo[3,4-c][1,4]oxazepine
Identifiers4,13-dimethyl-5-(phenylmethyl)-8-oxa-3-thia-1,11,12-triazatricyclo[8.3.0.0^{2,6}]trideca-2(6),4,10,12-tetraene
FormulaC17 H17 N3 O S
Molecular Weight311.401
TypeNON-POLYMER
Isomeric SMILESCc1c(c2c(s1)-n3c(nnc3COC2)C)Cc4ccccc4
InChIInChI=1S/C17H17N3OS/c1-11-14(8-13-6-4-3-5-7-13)15-9-21-10-16-19-18-12(2)20(16)17(15)22-11/h3-7H,8-10H2,1-2H3
InChIKeyQLGVMPYXPORRCO-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count39
Chiral Atom Count0
Bond Count42
Aromatic Bond Count16

Related Resource References

Resource NameReference
PubChem 130345614