N-[3-[(4-propan-2-yloxyphenyl)carbonylcarbamothioylamino]phenyl]furan-2-carboxamide

Systemtic Name: N-[3-[(4-propan-2-yloxyphenyl)carbonylcarbamothioylamino]phenyl]furan-2-carboxamide Openeye Name: N-[3-[(4-isopropoxybenzoyl)carbamothioylamino]phenyl]furan-2-carboxamide CAS Name: N-[3-[[[[oxo-(4-propan-2-yloxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]phenyl]-2-furancarboxamide IUPAC Name: N-[3-[(4-propan-2-yloxybenzoyl)carbamothioylamino]phenyl]furan-2-carboxamide Traditional Name: N-[3-[(4-isopropoxybenzoyl)thiocarbamoylamino]phenyl]-2-furamide Formula: C22H21N3O4S MolecularWeight: 423.48484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)C3=CC=CO3

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)C3=CC=CO3

InChI

InChI=1S/C22H21N3O4S/c1-14(2)29-18-10-8-15(9-11-18)20(26)25-22(30)24-17-6-3-5-16(13-17)23-21(27)19-7-4-12-28-19/h3-14H,1-2H3,(H,23,27)(H2,24,25,26,30)