tert-butyl N-[12-[(1,3-diphenylpyrazol-4-yl)amino]-12-oxidanylidene-dodecyl]carbamate

Systemtic Name: tert-butyl N-[12-[(1,3-diphenylpyrazol-4-yl)amino]-12-oxidanylidene-dodecyl]carbamate Openeye Name: tert-butyl N-[12-[(1,3-diphenylpyrazol-4-yl)amino]-12-oxo-dodecyl]carbamate CAS Name: N-[12-[(1,3-diphenyl-4-pyrazolyl)amino]-12-oxododecyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[12-[(1,3-diphenylpyrazol-4-yl)amino]-12-oxododecyl]carbamate Traditional Name: N-[12-[(1,3-diphenylpyrazol-4-yl)amino]-12-keto-dodecyl]carbamic acid tert-butyl ester Formula: C32H44N4O3 MolecularWeight: 532.71676

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCCCCCCCCCC(=O)NC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)NCCCCCCCCCCCC(=O)NC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C32H44N4O3/c1-32(2,3)39-31(38)33-24-18-10-8-6-4-5-7-9-17-23-29(37)34-28-25-36(27-21-15-12-16-22-27)35-30(28)26-19-13-11-14-20-26/h11-16,19-22,25H,4-10,17-18,23-24H2,1-3H3,(H,33,38)(H,34,37)