N-[[4-(2-cyclohexylethoxy)phenyl]carbamothioyl]-4-heptoxy-benzamide

Systemtic Name: N-[[4-(2-cyclohexylethoxy)phenyl]carbamothioyl]-4-heptoxy-benzamide Openeye Name: N-[[4-(2-cyclohexylethoxy)phenyl]carbamothioyl]-4-heptoxy-benzamide CAS Name: N-[[4-(2-cyclohexylethoxy)anilino]-sulfanylidenemethyl]-4-heptoxybenzamide IUPAC Name: N-[[4-(2-cyclohexylethoxy)phenyl]carbamothioyl]-4-heptoxybenzamide Traditional Name: N-[[4-(2-cyclohexylethoxy)phenyl]thiocarbamoyl]-4-heptoxy-benzamide Formula: C29H40N2O3S MolecularWeight: 496.7045

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)OCCC3CCCCC3

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)OCCC3CCCCC3

InChI

InChI=1S/C29H40N2O3S/c1-2-3-4-5-9-21-33-26-16-12-24(13-17-26)28(32)31-29(35)30-25-14-18-27(19-15-25)34-22-20-23-10-7-6-8-11-23/h12-19,23H,2-11,20-22H2,1H3,(H2,30,31,32,35)