S-(1-phenyl-1,2,3,4-tetrazol-5-yl) 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbothioate

Systemtic Name: S-(1-phenyl-1,2,3,4-tetrazol-5-yl) 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbothioate Openeye Name: S-(1-phenyltetrazol-5-yl) 3-(2-chlorophenyl)-5-methyl-isoxazole-4-carbothioate CAS Name: 3-(2-chlorophenyl)-5-methyl-4-isoxazolecarbothioic acid S-(1-phenyl-5-tetrazolyl) ester IUPAC Name: S-(1-phenyltetrazol-5-yl) 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbothioate Traditional Name: 3-(2-chlorophenyl)-5-methyl-isoxazole-4-carbothioic acid S-(1-phenyltetrazol-5-yl) ester Formula: C18H12ClN5O2S MolecularWeight: 397.83818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)SC3=NN=NN3C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)SC3=NN=NN3C4=CC=CC=C4

InChI

InChI=1S/C18H12ClN5O2S/c1-11-15(16(21-26-11)13-9-5-6-10-14(13)19)17(25)27-18-20-22-23-24(18)12-7-3-2-4-8-12/h2-10H,1H3