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

Systemtic Name: N-[2-[2-[[4-(aminomethyl)phenyl]methylamino]-2-oxidanylidene-ethyl]phenyl]-5-tert-butyl-2-methyl-pyrazole-3-carboxamide Openeye Name: N-[2-[2-[[4-(aminomethyl)phenyl]methylamino]-2-oxo-ethyl]phenyl]-5-tert-butyl-2-methyl-pyrazole-3-carboxamide CAS Name: N-[2-[2-[[4-(aminomethyl)phenyl]methylamino]-2-oxoethyl]phenyl]-5-tert-butyl-2-methyl-3-pyrazolecarboxamide IUPAC Name: N-[2-[2-[[4-(aminomethyl)phenyl]methylamino]-2-oxoethyl]phenyl]-5-tert-butyl-2-methylpyrazole-3-carboxamide Traditional Name: N-[2-[2-[[4-(aminomethyl)benzyl]amino]-2-keto-ethyl]phenyl]-5-tert-butyl-2-methyl-pyrazole-3-carboxamide Formula: C25H31N5O2 MolecularWeight: 433.54594

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)C(=O)NC2=CC=CC=C2CC(=O)NCC3=CC=C(C=C3)CN)C

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)C(=O)NC2=CC=CC=C2CC(=O)NCC3=CC=C(C=C3)CN)C

InChI

InChI=1S/C25H31N5O2/c1-25(2,3)22-14-21(30(4)29-22)24(32)28-20-8-6-5-7-19(20)13-23(31)27-16-18-11-9-17(15-26)10-12-18/h5-12,14H,13,15-16,26H2,1-4H3,(H,27,31)(H,28,32)