4-butoxy-N-[[2-(3,4-dimethylphenoxy)propanoylamino]carbamothioyl]benzamide

Systemtic Name: 4-butoxy-N-[[2-(3,4-dimethylphenoxy)propanoylamino]carbamothioyl]benzamide Openeye Name: 4-butoxy-N-[[2-(3,4-dimethylphenoxy)propanoylamino]carbamothioyl]benzamide CAS Name: 4-butoxy-N-[[[2-(3,4-dimethylphenoxy)-1-oxopropyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 4-butoxy-N-[[2-(3,4-dimethylphenoxy)propanoylamino]carbamothioyl]benzamide Traditional Name: 4-butoxy-N-[[2-(3,4-dimethylphenoxy)propanoylamino]thiocarbamoyl]benzamide Formula: C23H29N3O4S MolecularWeight: 443.55906

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C(C)OC2=CC(=C(C=C2)C)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C(C)OC2=CC(=C(C=C2)C)C

InChI

InChI=1S/C23H29N3O4S/c1-5-6-13-29-19-11-8-18(9-12-19)22(28)24-23(31)26-25-21(27)17(4)30-20-10-7-15(2)16(3)14-20/h7-12,14,17H,5-6,13H2,1-4H3,(H,25,27)(H2,24,26,28,31)