ethyl 2-[[2-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-[1,2,4]triazolo[1,5-c]quinazolin-5-yl]sulfanyl]ethanoate

Systemtic Name: ethyl 2-[[2-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-[1,2,4]triazolo[1,5-c]quinazolin-5-yl]sulfanyl]ethanoate Openeye Name: ethyl 2-[[2-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-[1,2,4]triazolo[1,5-c]quinazolin-5-yl]sulfanyl]acetate CAS Name: 2-[[2-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-[1,2,4]triazolo[1,5-c]quinazolin-5-yl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[[2-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-[1,2,4]triazolo[1,5-c]quinazolin-5-yl]sulfanyl]acetate Traditional Name: 2-[[2-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-[1,2,4]triazolo[1,5-c]quinazolin-5-yl]thio]acetic acid ethyl ester Formula: C20H22N6O2S MolecularWeight: 410.49268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC2=CC=CC=C2C3=NC(=NN31)CCC4=C(NN=C4C)C

Isomeric SMILES

CCOC(=O)CSC1=NC2=CC=CC=C2C3=NC(=NN31)CCC4=C(NN=C4C)C

InChI

InChI=1S/C20H22N6O2S/c1-4-28-18(27)11-29-20-21-16-8-6-5-7-15(16)19-22-17(25-26(19)20)10-9-14-12(2)23-24-13(14)3/h5-8H,4,9-11H2,1-3H3,(H,23,24)