N-[3-(3-cyclohexylpropanoylcarbamothioylamino)phenyl]-2-methyl-propanamide

Systemtic Name: N-[3-(3-cyclohexylpropanoylcarbamothioylamino)phenyl]-2-methyl-propanamide Openeye Name: N-[3-(3-cyclohexylpropanoylcarbamothioylamino)phenyl]-2-methyl-propanamide CAS Name: N-[3-[[[(3-cyclohexyl-1-oxopropyl)amino]-sulfanylidenemethyl]amino]phenyl]-2-methylpropanamide IUPAC Name: N-[3-(3-cyclohexylpropanoylcarbamothioylamino)phenyl]-2-methylpropanamide Traditional Name: N-[3-(3-cyclohexylpropanoylthiocarbamoylamino)phenyl]-2-methyl-propionamide Formula: C20H29N3O2S MolecularWeight: 375.52816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)CCC2CCCCC2

Isomeric SMILES

CC(C)C(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)CCC2CCCCC2

InChI

InChI=1S/C20H29N3O2S/c1-14(2)19(25)21-16-9-6-10-17(13-16)22-20(26)23-18(24)12-11-15-7-4-3-5-8-15/h6,9-10,13-15H,3-5,7-8,11-12H2,1-2H3,(H,21,25)(H2,22,23,24,26)