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

Systemtic Name: N-[[2-(3,4-dimethylphenoxy)propanoylamino]carbamothioyl]-3-(3-methylbutoxy)benzamide Openeye Name: N-[[2-(3,4-dimethylphenoxy)propanoylamino]carbamothioyl]-3-isopentyloxy-benzamide CAS Name: N-[[[2-(3,4-dimethylphenoxy)-1-oxopropyl]hydrazo]-sulfanylidenemethyl]-3-(3-methylbutoxy)benzamide IUPAC Name: N-[[2-(3,4-dimethylphenoxy)propanoylamino]carbamothioyl]-3-(3-methylbutoxy)benzamide Traditional Name: N-[[2-(3,4-dimethylphenoxy)propanoylamino]thiocarbamoyl]-3-isoamoxy-benzamide Formula: C24H31N3O4S MolecularWeight: 457.58564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC(C)C(=O)NNC(=S)NC(=O)C2=CC(=CC=C2)OCCC(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)OC(C)C(=O)NNC(=S)NC(=O)C2=CC(=CC=C2)OCCC(C)C)C

InChI

InChI=1S/C24H31N3O4S/c1-15(2)11-12-30-20-8-6-7-19(14-20)23(29)25-24(32)27-26-22(28)18(5)31-21-10-9-16(3)17(4)13-21/h6-10,13-15,18H,11-12H2,1-5H3,(H,26,28)(H2,25,27,29,32)