N-[4-[1-[[4-(aminomethyl)phenyl]methylamino]-1-oxidanylidene-propan-2-yl]phenyl]-5-tert-butyl-2-methyl-pyrazole-3-carboxamide

Systemtic Name: N-[4-[1-[[4-(aminomethyl)phenyl]methylamino]-1-oxidanylidene-propan-2-yl]phenyl]-5-tert-butyl-2-methyl-pyrazole-3-carboxamide Openeye Name: N-[4-[2-[[4-(aminomethyl)phenyl]methylamino]-1-methyl-2-oxo-ethyl]phenyl]-5-tert-butyl-2-methyl-pyrazole-3-carboxamide CAS Name: N-[4-[1-[[4-(aminomethyl)phenyl]methylamino]-1-oxopropan-2-yl]phenyl]-5-tert-butyl-2-methyl-3-pyrazolecarboxamide IUPAC Name: N-[4-[1-[[4-(aminomethyl)phenyl]methylamino]-1-oxopropan-2-yl]phenyl]-5-tert-butyl-2-methylpyrazole-3-carboxamide Traditional Name: N-[4-[2-[[4-(aminomethyl)benzyl]amino]-2-keto-1-methyl-ethyl]phenyl]-5-tert-butyl-2-methyl-pyrazole-3-carboxamide Formula: C26H33N5O2 MolecularWeight: 447.57252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)NC(=O)C2=CC(=NN2C)C(C)(C)C)C(=O)NCC3=CC=C(C=C3)CN

Isomeric SMILES

CC(C1=CC=C(C=C1)NC(=O)C2=CC(=NN2C)C(C)(C)C)C(=O)NCC3=CC=C(C=C3)CN

InChI

InChI=1S/C26H33N5O2/c1-17(24(32)28-16-19-8-6-18(15-27)7-9-19)20-10-12-21(13-11-20)29-25(33)22-14-23(26(2,3)4)30-31(22)5/h6-14,17H,15-16,27H2,1-5H3,(H,28,32)(H,29,33)