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

Systemtic Name: 1-[2-oxidanylidene-4-(trifluoromethyl)chromen-7-yl]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[2-oxo-4-(trifluoromethyl)chromen-7-yl]thiourea CAS Name: 1-[2-oxo-4-(trifluoromethyl)-1-benzopyran-7-yl]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[2-oxo-4-(trifluoromethyl)chromen-7-yl]thiourea Traditional Name: 1-benzyl-3-[2-keto-4-(trifluoromethyl)chromen-7-yl]thiourea Formula: C18H13F3N2O2S MolecularWeight: 378.36823

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=S)NC2=CC3=C(C=C2)C(=CC(=O)O3)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CNC(=S)NC2=CC3=C(C=C2)C(=CC(=O)O3)C(F)(F)F

InChI

InChI=1S/C18H13F3N2O2S/c19-18(20,21)14-9-16(24)25-15-8-12(6-7-13(14)15)23-17(26)22-10-11-4-2-1-3-5-11/h1-9H,10H2,(H2,22,23,26)