[2-(3,5-dimethyl-4-phenylsulfanyl-pyrazol-1-yl)carbonylphenyl]-phenyl-methanone

Systemtic Name: [2-(3,5-dimethyl-4-phenylsulfanyl-pyrazol-1-yl)carbonylphenyl]-phenyl-methanone Openeye Name: [2-(3,5-dimethyl-4-phenylsulfanyl-pyrazole-1-carbonyl)phenyl]-phenyl-methanone CAS Name: [2-[[3,5-dimethyl-4-(phenylthio)-1-pyrazolyl]-oxomethyl]phenyl]-phenylmethanone IUPAC Name: [2-(3,5-dimethyl-4-phenylsulfanylpyrazole-1-carbonyl)phenyl]-phenylmethanone Traditional Name: [2-[3,5-dimethyl-4-(phenylthio)pyrazole-1-carbonyl]phenyl]-phenyl-methanone Formula: C25H20N2O2S MolecularWeight: 412.5035

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(=O)C2=CC=CC=C2C(=O)C3=CC=CC=C3)C)SC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=NN1C(=O)C2=CC=CC=C2C(=O)C3=CC=CC=C3)C)SC4=CC=CC=C4

InChI

InChI=1S/C25H20N2O2S/c1-17-24(30-20-13-7-4-8-14-20)18(2)27(26-17)25(29)22-16-10-9-15-21(22)23(28)19-11-5-3-6-12-19/h3-16H,1-2H3