copper (4-methylphenyl)sulfonyl-[2-[(4R)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]azanide

Systemtic Name: copper (4-methylphenyl)sulfonyl-[2-[(4R)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]azanide Openeye Name: copper [2-[(4R)-4-phenyl-4,5-dihydrooxazol-2-yl]phenyl]-(p-tolylsulfonyl)azanide CAS Name: copper (4-methylphenyl)sulfonyl-[2-[(4R)-4-phenyl-4,5-dihydrooxazol-2-yl]phenyl]azanide IUPAC Name: copper (4-methylphenyl)sulfonyl-[2-[(4R)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]azanide Traditional Name: cupric [2-[(4R)-4-phenyl-2-oxazolin-2-yl]phenyl]-tosyl-azanide Formula: C44H38CuN4O6S2 MolecularWeight: 846.47172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[N-]C2=CC=CC=C2C3=NC(CO3)C4=CC=CC=C4.CC1=CC=C(C=C1)S(=O)(=O)[N-]C2=CC=CC=C2C3=NC(CO3)C4=CC=CC=C4.[Cu+2]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[N-]C2=CC=CC=C2C3=N[C@@H](CO3)C4=CC=CC=C4.CC1=CC=C(C=C1)S(=O)(=O)[N-]C2=CC=CC=C2C3=N[C@@H](CO3)C4=CC=CC=C4.[Cu+2]

InChI

InChI=1S/2C22H19N2O3S.Cu/c2*1-16-11-13-18(14-12-16)28(25,26)24-20-10-6-5-9-19(20)22-23-21(15-27-22)17-7-3-2-4-8-17;/h2*2-14,21H,15H2,1H3;/q2*-1;+2/t2*21-;/m00./s1