5-butyl-4-methylsulfanyl-N-phenyl-3-(phenylsulfonyl)-1,3-thiazol-2-imine

Systemtic Name: 5-butyl-4-methylsulfanyl-N-phenyl-3-(phenylsulfonyl)-1,3-thiazol-2-imine Openeye Name: 3-(benzenesulfonyl)-5-butyl-4-methylsulfanyl-N-phenyl-thiazol-2-imine CAS Name: 3-(benzenesulfonyl)-5-butyl-4-(methylthio)-N-phenyl-2-thiazolimine IUPAC Name: 3-(benzenesulfonyl)-5-butyl-4-methylsulfanyl-N-phenyl-1,3-thiazol-2-imine Traditional Name: [3-besyl-5-butyl-4-(methylthio)-4-thiazolin-2-ylidene]-phenyl-amine Formula: C20H22N2O2S3 MolecularWeight: 418.59588

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N(C(=NC2=CC=CC=C2)S1)S(=O)(=O)C3=CC=CC=C3)SC

Isomeric SMILES

CCCCC1=C(N(C(=NC2=CC=CC=C2)S1)S(=O)(=O)C3=CC=CC=C3)SC

InChI

InChI=1S/C20H22N2O2S3/c1-3-4-15-18-19(25-2)22(27(23,24)17-13-9-6-10-14-17)20(26-18)21-16-11-7-5-8-12-16/h5-14H,3-4,15H2,1-2H3