3-(3-cyclohexylpropanoylcarbamothioylamino)-N-(oxolan-2-ylmethyl)benzamide

Systemtic Name: 3-(3-cyclohexylpropanoylcarbamothioylamino)-N-(oxolan-2-ylmethyl)benzamide Openeye Name: 3-(3-cyclohexylpropanoylcarbamothioylamino)-N-(tetrahydrofuran-2-ylmethyl)benzamide CAS Name: 3-[[[(3-cyclohexyl-1-oxopropyl)amino]-sulfanylidenemethyl]amino]-N-(2-oxolanylmethyl)benzamide IUPAC Name: 3-(3-cyclohexylpropanoylcarbamothioylamino)-N-(oxolan-2-ylmethyl)benzamide Traditional Name: 3-(3-cyclohexylpropanoylthiocarbamoylamino)-N-(tetrahydrofurfuryl)benzamide Formula: C22H31N3O3S MolecularWeight: 417.56484

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCC(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NCC3CCCO3

Isomeric SMILES

C1CCC(CC1)CCC(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NCC3CCCO3

InChI

InChI=1S/C22H31N3O3S/c26-20(12-11-16-6-2-1-3-7-16)25-22(29)24-18-9-4-8-17(14-18)21(27)23-15-19-10-5-13-28-19/h4,8-9,14,16,19H,1-3,5-7,10-13,15H2,(H,23,27)(H2,24,25,26,29)