1-(1,3-benzodioxol-5-ylmethyl)-3-[2-oxidanylidene-4-(trifluoromethyl)chromen-6-yl]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-oxidanylidene-4-(trifluoromethyl)chromen-6-yl]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-oxo-4-(trifluoromethyl)chromen-6-yl]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-oxo-4-(trifluoromethyl)-1-benzopyran-6-yl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-oxo-4-(trifluoromethyl)chromen-6-yl]thiourea Traditional Name: 1-[2-keto-4-(trifluoromethyl)chromen-6-yl]-3-piperonyl-thiourea Formula: C19H13F3N2O4S MolecularWeight: 422.37773

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=S)NC3=CC4=C(C=C3)OC(=O)C=C4C(F)(F)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=S)NC3=CC4=C(C=C3)OC(=O)C=C4C(F)(F)F

InChI

InChI=1S/C19H13F3N2O4S/c20-19(21,22)13-7-17(25)28-14-4-2-11(6-12(13)14)24-18(29)23-8-10-1-3-15-16(5-10)27-9-26-15/h1-7H,8-9H2,(H2,23,24,29)