ethyl 2-[2-[(4-iodanyl-1-methyl-pyrazol-3-yl)carbonylamino]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-[(4-iodanyl-1-methyl-pyrazol-3-yl)carbonylamino]-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[(4-iodo-1-methyl-pyrazole-3-carbonyl)amino]thiazol-4-yl]acetate CAS Name: 2-[2-[[(4-iodo-1-methyl-3-pyrazolyl)-oxomethyl]amino]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[(4-iodo-1-methylpyrazole-3-carbonyl)amino]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[(4-iodo-1-methyl-pyrazole-3-carbonyl)amino]thiazol-4-yl]acetic acid ethyl ester Formula: C12H13IN4O3S MolecularWeight: 420.22609

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CSC(=N1)NC(=O)C2=NN(C=C2I)C

Isomeric SMILES

CCOC(=O)CC1=CSC(=N1)NC(=O)C2=NN(C=C2I)C

InChI

InChI=1S/C12H13IN4O3S/c1-3-20-9(18)4-7-6-21-12(14-7)15-11(19)10-8(13)5-17(2)16-10/h5-6H,3-4H2,1-2H3,(H,14,15,19)