[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-3-nitro-phenyl]-phenyl-methanone

Systemtic Name: [4-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-3-nitro-phenyl]-phenyl-methanone Openeye Name: [4-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]-3-nitro-phenyl]-phenyl-methanone CAS Name: [4-[(3,5-dimethyl-4-isoxazolyl)methylthio]-3-nitrophenyl]-phenylmethanone IUPAC Name: [4-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-3-nitrophenyl]-phenylmethanone Traditional Name: [4-[(3,5-dimethylisoxazol-4-yl)methylthio]-3-nitro-phenyl]-phenyl-methanone Formula: C19H16N2O4S MolecularWeight: 368.40634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSC2=C(C=C(C=C2)C(=O)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NO1)C)CSC2=C(C=C(C=C2)C(=O)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H16N2O4S/c1-12-16(13(2)25-20-12)11-26-18-9-8-15(10-17(18)21(23)24)19(22)14-6-4-3-5-7-14/h3-10H,11H2,1-2H3