2-[2-ethoxy-5-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]phenyl]benzotriazole

Systemtic Name: 2-[2-ethoxy-5-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]phenyl]benzotriazole Openeye Name: 2-[2-ethoxy-5-[(1-phenyltetrazol-5-yl)sulfanylmethyl]phenyl]benzotriazole CAS Name: 2-[2-ethoxy-5-[[(1-phenyl-5-tetrazolyl)thio]methyl]phenyl]benzotriazole IUPAC Name: 2-[2-ethoxy-5-[(1-phenyltetrazol-5-yl)sulfanylmethyl]phenyl]benzotriazole Traditional Name: 2-[2-ethoxy-5-[[(1-phenyltetrazol-5-yl)thio]methyl]phenyl]benzotriazole Formula: C22H19N7OS MolecularWeight: 429.49756

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CSC2=NN=NN2C3=CC=CC=C3)N4N=C5C=CC=CC5=N4

Isomeric SMILES

CCOC1=C(C=C(C=C1)CSC2=NN=NN2C3=CC=CC=C3)N4N=C5C=CC=CC5=N4

InChI

InChI=1S/C22H19N7OS/c1-2-30-21-13-12-16(14-20(21)29-24-18-10-6-7-11-19(18)25-29)15-31-22-23-26-27-28(22)17-8-4-3-5-9-17/h3-14H,2,15H2,1H3