3-bromanyl-4-propoxy-N-[(2,4,6-trimethylphenyl)carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-propoxy-N-[(2,4,6-trimethylphenyl)carbamothioyl]benzamide Openeye Name: 3-bromo-4-propoxy-N-[(2,4,6-trimethylphenyl)carbamothioyl]benzamide CAS Name: 3-bromo-4-propoxy-N-[sulfanylidene-(2,4,6-trimethylanilino)methyl]benzamide IUPAC Name: 3-bromo-4-propoxy-N-[(2,4,6-trimethylphenyl)carbamothioyl]benzamide Traditional Name: 3-bromo-N-(mesitylthiocarbamoyl)-4-propoxy-benzamide Formula: C20H23BrN2O2S MolecularWeight: 435.37782

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=C(C=C(C=C2C)C)C)Br

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=C(C=C(C=C2C)C)C)Br

InChI

InChI=1S/C20H23BrN2O2S/c1-5-8-25-17-7-6-15(11-16(17)21)19(24)23-20(26)22-18-13(3)9-12(2)10-14(18)4/h6-7,9-11H,5,8H2,1-4H3,(H2,22,23,24,26)