10-[2-[1-(4-methylphenyl)sulfonyl-1,2,3,4-tetrazol-5-yl]ethyl]phenothiazine

Systemtic Name: 10-[2-[1-(4-methylphenyl)sulfonyl-1,2,3,4-tetrazol-5-yl]ethyl]phenothiazine Openeye Name: 10-[2-[1-(p-tolylsulfonyl)tetrazol-5-yl]ethyl]phenothiazine CAS Name: 10-[2-[1-(4-methylphenyl)sulfonyl-5-tetrazolyl]ethyl]phenothiazine IUPAC Name: 10-[2-[1-(4-methylphenyl)sulfonyltetrazol-5-yl]ethyl]phenothiazine Traditional Name: 10-[2-(1-tosyltetrazol-5-yl)ethyl]phenothiazine Formula: C22H19N5O2S2 MolecularWeight: 449.54856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(=NN=N2)CCN3C4=CC=CC=C4SC5=CC=CC=C53

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C(=NN=N2)CCN3C4=CC=CC=C4SC5=CC=CC=C53

InChI

InChI=1S/C22H19N5O2S2/c1-16-10-12-17(13-11-16)31(28,29)27-22(23-24-25-27)14-15-26-18-6-2-4-8-20(18)30-21-9-5-3-7-19(21)26/h2-13H,14-15H2,1H3