N-[(2S)-1-[(1,3-diphenylpyrazol-4-yl)methylamino]-3-methyl-1-oxidanylidene-butan-2-yl]furan-2-carboxamide

Systemtic Name: N-[(2S)-1-[(1,3-diphenylpyrazol-4-yl)methylamino]-3-methyl-1-oxidanylidene-butan-2-yl]furan-2-carboxamide Openeye Name: N-[(1S)-1-[(1,3-diphenylpyrazol-4-yl)methylcarbamoyl]-2-methyl-propyl]furan-2-carboxamide CAS Name: N-[(2S)-1-[(1,3-diphenyl-4-pyrazolyl)methylamino]-3-methyl-1-oxobutan-2-yl]-2-furancarboxamide IUPAC Name: N-[(2S)-1-[(1,3-diphenylpyrazol-4-yl)methylamino]-3-methyl-1-oxobutan-2-yl]furan-2-carboxamide Traditional Name: N-[(1S)-1-[(1,3-diphenylpyrazol-4-yl)methylcarbamoyl]-2-methyl-propyl]-2-furamide Formula: C26H26N4O3 MolecularWeight: 442.50964

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3)NC(=O)C4=CC=CO4

Isomeric SMILES

CC(C)[C@@H](C(=O)NCC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3)NC(=O)C4=CC=CO4

InChI

InChI=1S/C26H26N4O3/c1-18(2)23(28-25(31)22-14-9-15-33-22)26(32)27-16-20-17-30(21-12-7-4-8-13-21)29-24(20)19-10-5-3-6-11-19/h3-15,17-18,23H,16H2,1-2H3,(H,27,32)(H,28,31)/t23-/m0/s1