3-[2-(4-methoxyphenyl)ethanoylcarbamothioylamino]-N-(oxolan-2-ylmethyl)benzamide

Systemtic Name: 3-[2-(4-methoxyphenyl)ethanoylcarbamothioylamino]-N-(oxolan-2-ylmethyl)benzamide Openeye Name: 3-[[2-(4-methoxyphenyl)acetyl]carbamothioylamino]-N-(tetrahydrofuran-2-ylmethyl)benzamide CAS Name: 3-[[[[2-(4-methoxyphenyl)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]-N-(2-oxolanylmethyl)benzamide IUPAC Name: 3-[[2-(4-methoxyphenyl)acetyl]carbamothioylamino]-N-(oxolan-2-ylmethyl)benzamide Traditional Name: 3-[[2-(4-methoxyphenyl)acetyl]thiocarbamoylamino]-N-(tetrahydrofurfuryl)benzamide Formula: C22H25N3O4S MolecularWeight: 427.5166

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NCC3CCCO3

Isomeric SMILES

COC1=CC=C(C=C1)CC(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NCC3CCCO3

InChI

InChI=1S/C22H25N3O4S/c1-28-18-9-7-15(8-10-18)12-20(26)25-22(30)24-17-5-2-4-16(13-17)21(27)23-14-19-6-3-11-29-19/h2,4-5,7-10,13,19H,3,6,11-12,14H2,1H3,(H,23,27)(H2,24,25,26,30)