2-chloranyl-N-[[2,3,5,6-tetramethyl-4-(4-nonylphenoxy)phenyl]carbamothioyl]benzamide

Systemtic Name: 2-chloranyl-N-[[2,3,5,6-tetramethyl-4-(4-nonylphenoxy)phenyl]carbamothioyl]benzamide Openeye Name: 2-chloro-N-[[2,3,5,6-tetramethyl-4-(4-nonylphenoxy)phenyl]carbamothioyl]benzamide CAS Name: 2-chloro-N-[sulfanylidene-[2,3,5,6-tetramethyl-4-(4-nonylphenoxy)anilino]methyl]benzamide IUPAC Name: 2-chloro-N-[[2,3,5,6-tetramethyl-4-(4-nonylphenoxy)phenyl]carbamothioyl]benzamide Traditional Name: 2-chloro-N-[[2,3,5,6-tetramethyl-4-(4-nonylphenoxy)phenyl]thiocarbamoyl]benzamide Formula: C33H41ClN2O2S MolecularWeight: 565.20884

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC=C(C=C1)OC2=C(C(=C(C(=C2C)C)NC(=S)NC(=O)C3=CC=CC=C3Cl)C)C

Isomeric SMILES

CCCCCCCCCC1=CC=C(C=C1)OC2=C(C(=C(C(=C2C)C)NC(=S)NC(=O)C3=CC=CC=C3Cl)C)C

InChI

InChI=1S/C33H41ClN2O2S/c1-6-7-8-9-10-11-12-15-26-18-20-27(21-19-26)38-31-24(4)22(2)30(23(3)25(31)5)35-33(39)36-32(37)28-16-13-14-17-29(28)34/h13-14,16-21H,6-12,15H2,1-5H3,(H2,35,36,37,39)