5-azanyl-1-tert-butyl-3-[4-(naphthalen-2-ylcarbamoylamino)phenyl]pyrazole-4-carboxamide

Systemtic Name: 5-azanyl-1-tert-butyl-3-[4-(naphthalen-2-ylcarbamoylamino)phenyl]pyrazole-4-carboxamide Openeye Name: 5-amino-1-tert-butyl-3-[4-(2-naphthylcarbamoylamino)phenyl]pyrazole-4-carboxamide CAS Name: 5-amino-1-tert-butyl-3-[4-[[(2-naphthalenylamino)-oxomethyl]amino]phenyl]-4-pyrazolecarboxamide IUPAC Name: 5-amino-1-tert-butyl-3-[4-(naphthalen-2-ylcarbamoylamino)phenyl]pyrazole-4-carboxamide Traditional Name: 5-amino-1-tert-butyl-3-[4-(2-naphthylcarbamoylamino)phenyl]pyrazole-4-carboxamide Formula: C25H26N6O2 MolecularWeight: 442.51294

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=C(C(=N1)C2=CC=C(C=C2)NC(=O)NC3=CC4=CC=CC=C4C=C3)C(=O)N)N

Isomeric SMILES

CC(C)(C)N1C(=C(C(=N1)C2=CC=C(C=C2)NC(=O)NC3=CC4=CC=CC=C4C=C3)C(=O)N)N

InChI

InChI=1S/C25H26N6O2/c1-25(2,3)31-22(26)20(23(27)32)21(30-31)16-9-11-18(12-10-16)28-24(33)29-19-13-8-15-6-4-5-7-17(15)14-19/h4-14H,26H2,1-3H3,(H2,27,32)(H2,28,29,33)