3-bromanyl-N-[[3-(cyclohexylcarbamoyl)phenyl]carbamothioyl]-4-propoxy-benzamide

Systemtic Name: 3-bromanyl-N-[[3-(cyclohexylcarbamoyl)phenyl]carbamothioyl]-4-propoxy-benzamide Openeye Name: 3-bromo-N-[[3-(cyclohexylcarbamoyl)phenyl]carbamothioyl]-4-propoxy-benzamide CAS Name: 3-bromo-N-[[3-[(cyclohexylamino)-oxomethyl]anilino]-sulfanylidenemethyl]-4-propoxybenzamide IUPAC Name: 3-bromo-N-[[3-(cyclohexylcarbamoyl)phenyl]carbamothioyl]-4-propoxybenzamide Traditional Name: 3-bromo-N-[[3-(cyclohexylcarbamoyl)phenyl]thiocarbamoyl]-4-propoxy-benzamide Formula: C24H28BrN3O3S MolecularWeight: 518.46642

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC3CCCCC3)Br

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC3CCCCC3)Br

InChI

InChI=1S/C24H28BrN3O3S/c1-2-13-31-21-12-11-17(15-20(21)25)23(30)28-24(32)27-19-10-6-7-16(14-19)22(29)26-18-8-4-3-5-9-18/h6-7,10-12,14-15,18H,2-5,8-9,13H2,1H3,(H,26,29)(H2,27,28,30,32)