3-(4-methylphenyl)sulfonyl-2-phenethyl-2H-1,3-benzothiazole

Systemtic Name: 3-(4-methylphenyl)sulfonyl-2-phenethyl-2H-1,3-benzothiazole Openeye Name: 2-phenethyl-3-(p-tolylsulfonyl)-2H-1,3-benzothiazole CAS Name: 3-(4-methylphenyl)sulfonyl-2-phenethyl-2H-1,3-benzothiazole IUPAC Name: 3-(4-methylphenyl)sulfonyl-2-phenethyl-2H-1,3-benzothiazole Traditional Name: 2-phenethyl-3-tosyl-2H-1,3-benzothiazole Formula: C22H21NO2S2 MolecularWeight: 395.53764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(SC3=CC=CC=C32)CCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C(SC3=CC=CC=C32)CCC4=CC=CC=C4

InChI

InChI=1S/C22H21NO2S2/c1-17-11-14-19(15-12-17)27(24,25)23-20-9-5-6-10-21(20)26-22(23)16-13-18-7-3-2-4-8-18/h2-12,14-15,22H,13,16H2,1H3