(2-bromanyl-4-chloranyl-phenyl) 2-(5-oxidanylidene-4-thiophen-2-yl-1,2,3,4-tetrazol-1-yl)ethanoate

Systemtic Name: (2-bromanyl-4-chloranyl-phenyl) 2-(5-oxidanylidene-4-thiophen-2-yl-1,2,3,4-tetrazol-1-yl)ethanoate Openeye Name: (2-bromo-4-chloro-phenyl) 2-[5-oxo-4-(2-thienyl)tetrazol-1-yl]acetate CAS Name: 2-(5-oxo-4-thiophen-2-yl-1-tetrazolyl)acetic acid (2-bromo-4-chlorophenyl) ester IUPAC Name: (2-bromo-4-chlorophenyl) 2-(5-oxo-4-thiophen-2-yltetrazol-1-yl)acetate Traditional Name: 2-[5-keto-4-(2-thienyl)tetrazol-1-yl]acetic acid (2-bromo-4-chloro-phenyl) ester Formula: C13H8BrClN4O3S MolecularWeight: 415.64962

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)N2C(=O)N(N=N2)CC(=O)OC3=C(C=C(C=C3)Cl)Br

Isomeric SMILES

C1=CSC(=C1)N2C(=O)N(N=N2)CC(=O)OC3=C(C=C(C=C3)Cl)Br

InChI

InChI=1S/C13H8BrClN4O3S/c14-9-6-8(15)3-4-10(9)22-12(20)7-18-13(21)19(17-16-18)11-2-1-5-23-11/h1-6H,7H2