(6-bromanylnaphthalen-2-yl) 2-(5-oxidanylidene-4-thiophen-2-yl-1,2,3,4-tetrazol-1-yl)ethanoate

Systemtic Name: (6-bromanylnaphthalen-2-yl) 2-(5-oxidanylidene-4-thiophen-2-yl-1,2,3,4-tetrazol-1-yl)ethanoate Openeye Name: (6-bromo-2-naphthyl) 2-[5-oxo-4-(2-thienyl)tetrazol-1-yl]acetate CAS Name: 2-(5-oxo-4-thiophen-2-yl-1-tetrazolyl)acetic acid (6-bromo-2-naphthalenyl) ester IUPAC Name: (6-bromonaphthalen-2-yl) 2-(5-oxo-4-thiophen-2-yltetrazol-1-yl)acetate Traditional Name: 2-[5-keto-4-(2-thienyl)tetrazol-1-yl]acetic acid (6-bromo-2-naphthyl) ester Formula: C17H11BrN4O3S MolecularWeight: 431.26324

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)N2C(=O)N(N=N2)CC(=O)OC3=CC4=C(C=C3)C=C(C=C4)Br

Isomeric SMILES

C1=CSC(=C1)N2C(=O)N(N=N2)CC(=O)OC3=CC4=C(C=C3)C=C(C=C4)Br

InChI

InChI=1S/C17H11BrN4O3S/c18-13-5-3-12-9-14(6-4-11(12)8-13)25-16(23)10-21-17(24)22(20-19-21)15-2-1-7-26-15/h1-9H,10H2