[(3R)-3-methyl-4-[4-(3-phenyl-1,2-oxazol-5-yl)phenyl]sulfonyl-piperazin-1-yl]-phenyl-methanone

Systemtic Name: [(3R)-3-methyl-4-[4-(3-phenyl-1,2-oxazol-5-yl)phenyl]sulfonyl-piperazin-1-yl]-phenyl-methanone Openeye Name: [(3R)-3-methyl-4-[4-(3-phenylisoxazol-5-yl)phenyl]sulfonyl-piperazin-1-yl]-phenyl-methanone CAS Name: [(3R)-3-methyl-4-[4-(3-phenyl-5-isoxazolyl)phenyl]sulfonyl-1-piperazinyl]-phenylmethanone IUPAC Name: [(3R)-3-methyl-4-[4-(3-phenyl-1,2-oxazol-5-yl)phenyl]sulfonylpiperazin-1-yl]-phenylmethanone Traditional Name: [(3R)-3-methyl-4-[4-(3-phenylisoxazol-5-yl)phenyl]sulfonyl-piperazino]-phenyl-methanone Formula: C27H25N3O4S MolecularWeight: 487.5701

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1S(=O)(=O)C2=CC=C(C=C2)C3=CC(=NO3)C4=CC=CC=C4)C(=O)C5=CC=CC=C5

Isomeric SMILES

C[C@@H]1CN(CCN1S(=O)(=O)C2=CC=C(C=C2)C3=CC(=NO3)C4=CC=CC=C4)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C27H25N3O4S/c1-20-19-29(27(31)23-10-6-3-7-11-23)16-17-30(20)35(32,33)24-14-12-22(13-15-24)26-18-25(28-34-26)21-8-4-2-5-9-21/h2-15,18,20H,16-17,19H2,1H3/t20-/m1/s1