2-[2-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-[(1-phenylcyclobutyl)methyl]ethanamide

Systemtic Name: 2-[2-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-[(1-phenylcyclobutyl)methyl]ethanamide Openeye Name: 2-[2-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)amino]-2-oxo-ethyl]sulfanyl-N-[(1-phenylcyclobutyl)methyl]acetamide CAS Name: 2-[[2-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)amino]-2-oxoethyl]thio]-N-[(1-phenylcyclobutyl)methyl]acetamide IUPAC Name: 2-[2-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]-2-oxoethyl]sulfanyl-N-[(1-phenylcyclobutyl)methyl]acetamide Traditional Name: 2-[[2-keto-2-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)amino]ethyl]thio]-N-[(1-phenylcyclobutyl)methyl]acetamide Formula: C26H30N4O3S MolecularWeight: 478.6064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CSCC(=O)NCC3(CCC3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CSCC(=O)NCC3(CCC3)C4=CC=CC=C4

InChI

InChI=1S/C26H30N4O3S/c1-19-24(25(33)30(29(19)2)21-12-7-4-8-13-21)28-23(32)17-34-16-22(31)27-18-26(14-9-15-26)20-10-5-3-6-11-20/h3-8,10-13H,9,14-18H2,1-2H3,(H,27,31)(H,28,32)