[4-bromanyl-3-methyl-2-(1,2-oxazol-5-yl)phenyl] N-thiophen-3-ylsulfonylcarbamate

Systemtic Name: [4-bromanyl-3-methyl-2-(1,2-oxazol-5-yl)phenyl] N-thiophen-3-ylsulfonylcarbamate Openeye Name: (4-bromo-2-isoxazol-5-yl-3-methyl-phenyl) N-(3-thienylsulfonyl)carbamate CAS Name: N-(3-thiophenylsulfonyl)carbamic acid [4-bromo-2-(5-isoxazolyl)-3-methylphenyl] ester IUPAC Name: [4-bromo-3-methyl-2-(1,2-oxazol-5-yl)phenyl] N-thiophen-3-ylsulfonylcarbamate Traditional Name: N-(3-thienylsulfonyl)carbamic acid (4-bromo-2-isoxazol-5-yl-3-methyl-phenyl) ester Formula: C15H11BrN2O5S2 MolecularWeight: 443.29224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C2=CC=NO2)OC(=O)NS(=O)(=O)C3=CSC=C3)Br

Isomeric SMILES

CC1=C(C=CC(=C1C2=CC=NO2)OC(=O)NS(=O)(=O)C3=CSC=C3)Br

InChI

InChI=1S/C15H11BrN2O5S2/c1-9-11(16)2-3-12(14(9)13-4-6-17-23-13)22-15(19)18-25(20,21)10-5-7-24-8-10/h2-8H,1H3,(H,18,19)