N-[3-(3-cyclohexylpropanoylcarbamothioylamino)phenyl]butanamide

Systemtic Name: N-[3-(3-cyclohexylpropanoylcarbamothioylamino)phenyl]butanamide Openeye Name: N-[3-(3-cyclohexylpropanoylcarbamothioylamino)phenyl]butanamide CAS Name: N-[3-[[[(3-cyclohexyl-1-oxopropyl)amino]-sulfanylidenemethyl]amino]phenyl]butanamide IUPAC Name: N-[3-(3-cyclohexylpropanoylcarbamothioylamino)phenyl]butanamide Traditional Name: N-[3-(3-cyclohexylpropanoylthiocarbamoylamino)phenyl]butyramide Formula: C20H29N3O2S MolecularWeight: 375.52816

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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