2-[(3,4-diethoxyphenyl)methyl]-5-(4-methylsulfonylphenyl)-1,2,3,4-tetrazole

Systemtic Name: 2-[(3,4-diethoxyphenyl)methyl]-5-(4-methylsulfonylphenyl)-1,2,3,4-tetrazole Openeye Name: 2-[(3,4-diethoxyphenyl)methyl]-5-(4-methylsulfonylphenyl)tetrazole CAS Name: 2-[(3,4-diethoxyphenyl)methyl]-5-(4-methylsulfonylphenyl)tetrazole IUPAC Name: 2-[(3,4-diethoxyphenyl)methyl]-5-(4-methylsulfonylphenyl)tetrazole Traditional Name: 2-(3,4-diethoxybenzyl)-5-(4-mesylphenyl)tetrazole Formula: C19H22N4O4S MolecularWeight: 402.46738

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CN2N=C(N=N2)C3=CC=C(C=C3)S(=O)(=O)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CN2N=C(N=N2)C3=CC=C(C=C3)S(=O)(=O)C)OCC

InChI

InChI=1S/C19H22N4O4S/c1-4-26-17-11-6-14(12-18(17)27-5-2)13-23-21-19(20-22-23)15-7-9-16(10-8-15)28(3,24)25/h6-12H,4-5,13H2,1-3H3