ethyl 4-[2-[4-[(4-iodanyl-1-methyl-pyrazol-3-yl)carbonylamino]-3-methyl-pyrazol-1-yl]propanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[4-[(4-iodanyl-1-methyl-pyrazol-3-yl)carbonylamino]-3-methyl-pyrazol-1-yl]propanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[4-[(4-iodo-1-methyl-pyrazole-3-carbonyl)amino]-3-methyl-pyrazol-1-yl]propanoyl]piperazine-1-carboxylate CAS Name: 4-[2-[4-[[(4-iodo-1-methyl-3-pyrazolyl)-oxomethyl]amino]-3-methyl-1-pyrazolyl]-1-oxopropyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[4-[(4-iodo-1-methylpyrazole-3-carbonyl)amino]-3-methylpyrazol-1-yl]propanoyl]piperazine-1-carboxylate Traditional Name: 4-[2-[4-[(4-iodo-1-methyl-pyrazole-3-carbonyl)amino]-3-methyl-pyrazol-1-yl]propanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C19H26IN7O4 MolecularWeight: 543.35871

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C(C)N2C=C(C(=N2)C)NC(=O)C3=NN(C=C3I)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C(C)N2C=C(C(=N2)C)NC(=O)C3=NN(C=C3I)C

InChI

InChI=1S/C19H26IN7O4/c1-5-31-19(30)26-8-6-25(7-9-26)18(29)13(3)27-11-15(12(2)22-27)21-17(28)16-14(20)10-24(4)23-16/h10-11,13H,5-9H2,1-4H3,(H,21,28)