5-bromanyl-N-[[2-(propan-2-ylcarbamoyl)phenyl]carbamothioyl]-2-propoxy-benzamide

Systemtic Name: 5-bromanyl-N-[[2-(propan-2-ylcarbamoyl)phenyl]carbamothioyl]-2-propoxy-benzamide Openeye Name: 5-bromo-N-[[2-(isopropylcarbamoyl)phenyl]carbamothioyl]-2-propoxy-benzamide CAS Name: 5-bromo-N-[[2-[oxo-(propan-2-ylamino)methyl]anilino]-sulfanylidenemethyl]-2-propoxybenzamide IUPAC Name: 5-bromo-N-[[2-(propan-2-ylcarbamoyl)phenyl]carbamothioyl]-2-propoxybenzamide Traditional Name: 5-bromo-N-[[2-(isopropylcarbamoyl)phenyl]thiocarbamoyl]-2-propoxy-benzamide Formula: C21H24BrN3O3S MolecularWeight: 478.40256

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24BrN3O3S/c1-4-11-28-18-10-9-14(22)12-16(18)20(27)25-21(29)24-17-8-6-5-7-15(17)19(26)23-13(2)3/h5-10,12-13H,4,11H2,1-3H3,(H,23,26)(H2,24,25,27,29)