3-bromanyl-N-[[2-(4-methoxyphenoxy)ethanoylamino]carbamothioyl]-4-(3-methylbutoxy)benzamide

Systemtic Name: 3-bromanyl-N-[[2-(4-methoxyphenoxy)ethanoylamino]carbamothioyl]-4-(3-methylbutoxy)benzamide Openeye Name: 3-bromo-4-isopentyloxy-N-[[[2-(4-methoxyphenoxy)acetyl]amino]carbamothioyl]benzamide CAS Name: 3-bromo-N-[[[2-(4-methoxyphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-4-(3-methylbutoxy)benzamide IUPAC Name: 3-bromo-N-[[[2-(4-methoxyphenoxy)acetyl]amino]carbamothioyl]-4-(3-methylbutoxy)benzamide Traditional Name: 3-bromo-4-isoamoxy-N-[[[2-(4-methoxyphenoxy)acetyl]amino]thiocarbamoyl]benzamide Formula: C22H26BrN3O5S MolecularWeight: 524.42794

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)COC2=CC=C(C=C2)OC)Br

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)COC2=CC=C(C=C2)OC)Br

InChI

InChI=1S/C22H26BrN3O5S/c1-14(2)10-11-30-19-9-4-15(12-18(19)23)21(28)24-22(32)26-25-20(27)13-31-17-7-5-16(29-3)6-8-17/h4-9,12,14H,10-11,13H2,1-3H3,(H,25,27)(H2,24,26,28,32)