N-[4-(4-cyclohexylphenyl)-3-(2-methylsulfanylpyrimidin-5-yl)-1,3-thiazol-2-ylidene]benzamide

Systemtic Name: N-[4-(4-cyclohexylphenyl)-3-(2-methylsulfanylpyrimidin-5-yl)-1,3-thiazol-2-ylidene]benzamide Openeye Name: N-[4-(4-cyclohexylphenyl)-3-(2-methylsulfanylpyrimidin-5-yl)thiazol-2-ylidene]benzamide CAS Name: N-[4-(4-cyclohexylphenyl)-3-[2-(methylthio)-5-pyrimidinyl]-2-thiazolylidene]benzamide IUPAC Name: N-[4-(4-cyclohexylphenyl)-3-(2-methylsulfanylpyrimidin-5-yl)-1,3-thiazol-2-ylidene]benzamide Traditional Name: N-[4-(4-cyclohexylphenyl)-3-[2-(methylthio)pyrimidin-5-yl]-4-thiazolin-2-ylidene]benzamide Formula: C27H26N4OS2 MolecularWeight: 486.65154

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C=N1)N2C(=CSC2=NC(=O)C3=CC=CC=C3)C4=CC=C(C=C4)C5CCCCC5

Isomeric SMILES

CSC1=NC=C(C=N1)N2C(=CSC2=NC(=O)C3=CC=CC=C3)C4=CC=C(C=C4)C5CCCCC5

InChI

InChI=1S/C27H26N4OS2/c1-33-26-28-16-23(17-29-26)31-24(18-34-27(31)30-25(32)22-10-6-3-7-11-22)21-14-12-20(13-15-21)19-8-4-2-5-9-19/h3,6-7,10-19H,2,4-5,8-9H2,1H3