1-(3-methoxypropyl)-3-[2-oxidanylidene-4-(trifluoromethyl)chromen-7-yl]thiourea

Systemtic Name: 1-(3-methoxypropyl)-3-[2-oxidanylidene-4-(trifluoromethyl)chromen-7-yl]thiourea Openeye Name: 1-(3-methoxypropyl)-3-[2-oxo-4-(trifluoromethyl)chromen-7-yl]thiourea CAS Name: 1-(3-methoxypropyl)-3-[2-oxo-4-(trifluoromethyl)-1-benzopyran-7-yl]thiourea IUPAC Name: 1-(3-methoxypropyl)-3-[2-oxo-4-(trifluoromethyl)chromen-7-yl]thiourea Traditional Name: 1-[2-keto-4-(trifluoromethyl)chromen-7-yl]-3-(3-methoxypropyl)thiourea Formula: C15H15F3N2O3S MolecularWeight: 360.35141

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=S)NC1=CC2=C(C=C1)C(=CC(=O)O2)C(F)(F)F

Isomeric SMILES

COCCCNC(=S)NC1=CC2=C(C=C1)C(=CC(=O)O2)C(F)(F)F

InChI

InChI=1S/C15H15F3N2O3S/c1-22-6-2-5-19-14(24)20-9-3-4-10-11(15(16,17)18)8-13(21)23-12(10)7-9/h3-4,7-8H,2,5-6H2,1H3,(H2,19,20,24)