N-[3-[2-(4-tert-butylphenoxy)ethanoylcarbamothioylamino]phenyl]-2-methyl-propanamide

Systemtic Name: N-[3-[2-(4-tert-butylphenoxy)ethanoylcarbamothioylamino]phenyl]-2-methyl-propanamide Openeye Name: N-[3-[[2-(4-tert-butylphenoxy)acetyl]carbamothioylamino]phenyl]-2-methyl-propanamide CAS Name: N-[3-[[[[2-(4-tert-butylphenoxy)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]phenyl]-2-methylpropanamide IUPAC Name: N-[3-[[2-(4-tert-butylphenoxy)acetyl]carbamothioylamino]phenyl]-2-methylpropanamide Traditional Name: N-[3-[[2-(4-tert-butylphenoxy)acetyl]thiocarbamoylamino]phenyl]-2-methyl-propionamide Formula: C23H29N3O3S MolecularWeight: 427.55966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)COC2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC(C)C(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)COC2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C23H29N3O3S/c1-15(2)21(28)24-17-7-6-8-18(13-17)25-22(30)26-20(27)14-29-19-11-9-16(10-12-19)23(3,4)5/h6-13,15H,14H2,1-5H3,(H,24,28)(H2,25,26,27,30)