[4-(4-bromophenyl)sulfanyl-3,5-dimethyl-pyrazol-1-yl]-(furan-2-yl)methanone

Systemtic Name: [4-(4-bromophenyl)sulfanyl-3,5-dimethyl-pyrazol-1-yl]-(furan-2-yl)methanone Openeye Name: [4-(4-bromophenyl)sulfanyl-3,5-dimethyl-pyrazol-1-yl]-(2-furyl)methanone CAS Name: [4-[(4-bromophenyl)thio]-3,5-dimethyl-1-pyrazolyl]-(2-furanyl)methanone IUPAC Name: [4-(4-bromophenyl)sulfanyl-3,5-dimethylpyrazol-1-yl]-(furan-2-yl)methanone Traditional Name: [4-[(4-bromophenyl)thio]-3,5-dimethyl-pyrazol-1-yl]-(2-furyl)methanone Formula: C16H13BrN2O2S MolecularWeight: 377.25562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(=O)C2=CC=CO2)C)SC3=CC=C(C=C3)Br

Isomeric SMILES

CC1=C(C(=NN1C(=O)C2=CC=CO2)C)SC3=CC=C(C=C3)Br

InChI

InChI=1S/C16H13BrN2O2S/c1-10-15(22-13-7-5-12(17)6-8-13)11(2)19(18-10)16(20)14-4-3-9-21-14/h3-9H,1-2H3