2-cyano-N-hexan-3-ylsulfanyl-4-[4-[4-methyl-9-(trifluoromethyl)carbazol-3-yl]oxyphenoxy]-3-oxidanylidene-butanethioamide

Systemtic Name: 2-cyano-N-hexan-3-ylsulfanyl-4-[4-[4-methyl-9-(trifluoromethyl)carbazol-3-yl]oxyphenoxy]-3-oxidanylidene-butanethioamide Openeye Name: 2-cyano-N-(1-ethylbutylsulfanyl)-4-[4-[4-methyl-9-(trifluoromethyl)carbazol-3-yl]oxyphenoxy]-3-oxo-butanethioamide CAS Name: 2-cyano-N-(hexan-3-ylthio)-4-[4-[[4-methyl-9-(trifluoromethyl)-3-carbazolyl]oxy]phenoxy]-3-oxobutanethioamide IUPAC Name: 2-cyano-N-hexan-3-ylsulfanyl-4-[4-[4-methyl-9-(trifluoromethyl)carbazol-3-yl]oxyphenoxy]-3-oxobutanethioamide Traditional Name: 2-cyano-N-(1-ethylbutylthio)-3-keto-4-[4-[4-methyl-9-(trifluoromethyl)carbazol-3-yl]oxyphenoxy]thiobutyramide Formula: C31H30F3N3O3S2 MolecularWeight: 613.71341

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC)SNC(=S)C(C#N)C(=O)COC1=CC=C(C=C1)OC2=C(C3=C(C=C2)N(C4=CC=CC=C43)C(F)(F)F)C

Isomeric SMILES

CCCC(CC)SNC(=S)C(C#N)C(=O)COC1=CC=C(C=C1)OC2=C(C3=C(C=C2)N(C4=CC=CC=C43)C(F)(F)F)C

InChI

InChI=1S/C31H30F3N3O3S2/c1-4-8-22(5-2)42-36-30(41)24(17-35)27(38)18-39-20-11-13-21(14-12-20)40-28-16-15-26-29(19(28)3)23-9-6-7-10-25(23)37(26)31(32,33)34/h6-7,9-16,22,24H,4-5,8,18H2,1-3H3,(H,36,41)