2-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]-3-[[2-(trifluoromethylsulfanyl)phenyl]amino]prop-2-enenitrile

Systemtic Name: 2-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]-3-[[2-(trifluoromethylsulfanyl)phenyl]amino]prop-2-enenitrile Openeye Name: 2-[4-(3,4-dimethylphenyl)thiazol-2-yl]-3-[2-(trifluoromethylsulfanyl)anilino]prop-2-enenitrile CAS Name: 2-[4-(3,4-dimethylphenyl)-2-thiazolyl]-3-[2-(trifluoromethylthio)anilino]-2-propenenitrile IUPAC Name: 2-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]-3-[2-(trifluoromethylsulfanyl)anilino]prop-2-enenitrile Traditional Name: 2-[4-(3,4-dimethylphenyl)thiazol-2-yl]-3-[2-(trifluoromethylthio)anilino]acrylonitrile Formula: C21H16F3N3S2 MolecularWeight: 431.49705

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CSC(=N2)C(=CNC3=CC=CC=C3SC(F)(F)F)C#N)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CSC(=N2)C(=CNC3=CC=CC=C3SC(F)(F)F)C#N)C

InChI

InChI=1S/C21H16F3N3S2/c1-13-7-8-15(9-14(13)2)18-12-28-20(27-18)16(10-25)11-26-17-5-3-4-6-19(17)29-21(22,23)24/h3-9,11-12,26H,1-2H3