3-cyclohexyl-N-[[3-(2-phenoxyethanoylamino)phenyl]carbamothioyl]propanamide

Systemtic Name: 3-cyclohexyl-N-[[3-(2-phenoxyethanoylamino)phenyl]carbamothioyl]propanamide Openeye Name: 3-cyclohexyl-N-[[3-[(2-phenoxyacetyl)amino]phenyl]carbamothioyl]propanamide CAS Name: 3-cyclohexyl-N-[[3-[(1-oxo-2-phenoxyethyl)amino]anilino]-sulfanylidenemethyl]propanamide IUPAC Name: 3-cyclohexyl-N-[[3-[(2-phenoxyacetyl)amino]phenyl]carbamothioyl]propanamide Traditional Name: 3-cyclohexyl-N-[[3-[(2-phenoxyacetyl)amino]phenyl]thiocarbamoyl]propionamide Formula: C24H29N3O3S MolecularWeight: 439.57036

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCC(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)COC3=CC=CC=C3

Isomeric SMILES

C1CCC(CC1)CCC(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C24H29N3O3S/c28-22(15-14-18-8-3-1-4-9-18)27-24(31)26-20-11-7-10-19(16-20)25-23(29)17-30-21-12-5-2-6-13-21/h2,5-7,10-13,16,18H,1,3-4,8-9,14-15,17H2,(H,25,29)(H2,26,27,28,31)