N-(2-propan-2-ylpyrazol-3-yl)-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(2-propan-2-ylpyrazol-3-yl)-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: 2-[(4-allyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-isopropylpyrazol-3-yl)acetamide CAS Name: N-(2-propan-2-yl-3-pyrazolyl)-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(2-propan-2-ylpyrazol-3-yl)-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: 2-[(4-allyl-1,2,4-triazol-3-yl)thio]-N-(2-isopropylpyrazol-3-yl)acetamide Formula: C13H18N6OS MolecularWeight: 306.38662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=CC=N1)NC(=O)CSC2=NN=CN2CC=C

Isomeric SMILES

CC(C)N1C(=CC=N1)NC(=O)CSC2=NN=CN2CC=C

InChI

InChI=1S/C13H18N6OS/c1-4-7-18-9-14-17-13(18)21-8-12(20)16-11-5-6-15-19(11)10(2)3/h4-6,9-10H,1,7-8H2,2-3H3,(H,16,20)