ethyl 3-[3-tert-butyl-5-(naphthalen-1-ylcarbamoylamino)pyrazol-1-yl]benzoate

Systemtic Name: ethyl 3-[3-tert-butyl-5-(naphthalen-1-ylcarbamoylamino)pyrazol-1-yl]benzoate Openeye Name: ethyl 3-[3-tert-butyl-5-(1-naphthylcarbamoylamino)pyrazol-1-yl]benzoate CAS Name: 3-[3-tert-butyl-5-[[(1-naphthalenylamino)-oxomethyl]amino]-1-pyrazolyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-[3-tert-butyl-5-(naphthalen-1-ylcarbamoylamino)pyrazol-1-yl]benzoate Traditional Name: 3-[3-tert-butyl-5-(1-naphthylcarbamoylamino)pyrazol-1-yl]benzoic acid ethyl ester Formula: C27H28N4O3 MolecularWeight: 456.53622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)NC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)NC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C27H28N4O3/c1-5-34-25(32)19-12-8-13-20(16-19)31-24(17-23(30-31)27(2,3)4)29-26(33)28-22-15-9-11-18-10-6-7-14-21(18)22/h6-17H,5H2,1-4H3,(H2,28,29,33)