3,7-dimethyl-2-[5-(2-methyl-1,2,4-triazol-3-yl)-3-(trifluoromethyl)thiophen-2-yl]-5-pentan-3-yl-pyrrolo[2,3-b]pyrazine

Systemtic Name: 3,7-dimethyl-2-[5-(2-methyl-1,2,4-triazol-3-yl)-3-(trifluoromethyl)thiophen-2-yl]-5-pentan-3-yl-pyrrolo[2,3-b]pyrazine Openeye Name: 5-(1-ethylpropyl)-3,7-dimethyl-2-[5-(2-methyl-1,2,4-triazol-3-yl)-3-(trifluoromethyl)-2-thienyl]pyrrolo[2,3-b]pyrazine CAS Name: 3,7-dimethyl-2-[5-(2-methyl-1,2,4-triazol-3-yl)-3-(trifluoromethyl)-2-thiophenyl]-5-pentan-3-ylpyrrolo[2,3-b]pyrazine IUPAC Name: 3,7-dimethyl-2-[5-(2-methyl-1,2,4-triazol-3-yl)-3-(trifluoromethyl)thiophen-2-yl]-5-pentan-3-ylpyrrolo[2,3-b]pyrazine Traditional Name: 5-(1-ethylpropyl)-3,7-dimethyl-2-[5-(2-methyl-1,2,4-triazol-3-yl)-3-(trifluoromethyl)-2-thienyl]pyrrolo[2,3-b]pyrazine Formula: C21H23F3N6S MolecularWeight: 448.50773

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N1C=C(C2=C1N=C(C(=N2)C3=C(C=C(S3)C4=NC=NN4C)C(F)(F)F)C)C

Isomeric SMILES

CCC(CC)N1C=C(C2=C1N=C(C(=N2)C3=C(C=C(S3)C4=NC=NN4C)C(F)(F)F)C)C

InChI

InChI=1S/C21H23F3N6S/c1-6-13(7-2)30-9-11(3)16-20(30)27-12(4)17(28-16)18-14(21(22,23)24)8-15(31-18)19-25-10-26-29(19)5/h8-10,13H,6-7H2,1-5H3