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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CN2C(=O)N(N=N2)C3=CC=CS3)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CN2C(=O)N(N=N2)C3=CC=CS3)Br)OC

InChI

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