4-(3-cyclohexylpropanoylcarbamothioylamino)-N-(furan-2-ylmethyl)benzamide

Systemtic Name: 4-(3-cyclohexylpropanoylcarbamothioylamino)-N-(furan-2-ylmethyl)benzamide Openeye Name: 4-(3-cyclohexylpropanoylcarbamothioylamino)-N-(2-furylmethyl)benzamide CAS Name: 4-[[[(3-cyclohexyl-1-oxopropyl)amino]-sulfanylidenemethyl]amino]-N-(2-furanylmethyl)benzamide IUPAC Name: 4-(3-cyclohexylpropanoylcarbamothioylamino)-N-(furan-2-ylmethyl)benzamide Traditional Name: 4-(3-cyclohexylpropanoylthiocarbamoylamino)-N-(2-furfuryl)benzamide Formula: C22H27N3O3S MolecularWeight: 413.53308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCC(=O)NC(=S)NC2=CC=C(C=C2)C(=O)NCC3=CC=CO3

Isomeric SMILES

C1CCC(CC1)CCC(=O)NC(=S)NC2=CC=C(C=C2)C(=O)NCC3=CC=CO3

InChI

InChI=1S/C22H27N3O3S/c26-20(13-8-16-5-2-1-3-6-16)25-22(29)24-18-11-9-17(10-12-18)21(27)23-15-19-7-4-14-28-19/h4,7,9-12,14,16H,1-3,5-6,8,13,15H2,(H,23,27)(H2,24,25,26,29)