1-[(4-bromanyl-2,5-dimethoxy-phenyl)methyl]-4-thiophen-2-yl-1,2,3,4-tetrazol-5-one

Systemtic Name: 1-[(4-bromanyl-2,5-dimethoxy-phenyl)methyl]-4-thiophen-2-yl-1,2,3,4-tetrazol-5-one Openeye Name: 1-[(4-bromo-2,5-dimethoxy-phenyl)methyl]-4-(2-thienyl)tetrazol-5-one CAS Name: 1-[(4-bromo-2,5-dimethoxyphenyl)methyl]-4-thiophen-2-yl-5-tetrazolone IUPAC Name: 1-[(4-bromo-2,5-dimethoxyphenyl)methyl]-4-thiophen-2-yltetrazol-5-one Traditional Name: 1-(4-bromo-2,5-dimethoxy-benzyl)-4-(2-thienyl)tetrazol-5-one Formula: C14H13BrN4O3S MolecularWeight: 397.24702

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1CN2C(=O)N(N=N2)C3=CC=CS3)OC)Br

Isomeric SMILES

COC1=CC(=C(C=C1CN2C(=O)N(N=N2)C3=CC=CS3)OC)Br

InChI

InChI=1S/C14H13BrN4O3S/c1-21-11-7-10(15)12(22-2)6-9(11)8-18-14(20)19(17-16-18)13-4-3-5-23-13/h3-7H,8H2,1-2H3