N-[3-[2-(4-propan-2-ylphenoxy)ethanoylcarbamothioylamino]phenyl]pentanamide

Systemtic Name: N-[3-[2-(4-propan-2-ylphenoxy)ethanoylcarbamothioylamino]phenyl]pentanamide Openeye Name: N-[3-[[2-(4-isopropylphenoxy)acetyl]carbamothioylamino]phenyl]pentanamide CAS Name: N-[3-[[[[1-oxo-2-(4-propan-2-ylphenoxy)ethyl]amino]-sulfanylidenemethyl]amino]phenyl]pentanamide IUPAC Name: N-[3-[[2-(4-propan-2-ylphenoxy)acetyl]carbamothioylamino]phenyl]pentanamide Traditional Name: N-[3-[[2-(4-isopropylphenoxy)acetyl]thiocarbamoylamino]phenyl]valeramide Formula: C23H29N3O3S MolecularWeight: 427.55966

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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