1-[[2-oxidanylidene-5-(trifluoromethyloxy)indol-3-yl]amino]-3-phenyl-thiourea

Systemtic Name: 1-[[2-oxidanylidene-5-(trifluoromethyloxy)indol-3-yl]amino]-3-phenyl-thiourea Openeye Name: 1-[[2-oxo-5-(trifluoromethoxy)indol-3-yl]amino]-3-phenyl-thiourea CAS Name: 1-[[2-oxo-5-(trifluoromethoxy)-3-indolyl]amino]-3-phenylthiourea IUPAC Name: 1-[[2-oxo-5-(trifluoromethoxy)indol-3-yl]amino]-3-phenylthiourea Traditional Name: 1-[[2-keto-5-(trifluoromethoxy)indol-3-yl]amino]-3-phenyl-thiourea Formula: C16H11F3N4O2S MolecularWeight: 380.34435

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NNC2=C3C=C(C=CC3=NC2=O)OC(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NNC2=C3C=C(C=CC3=NC2=O)OC(F)(F)F

InChI

InChI=1S/C16H11F3N4O2S/c17-16(18,19)25-10-6-7-12-11(8-10)13(14(24)21-12)22-23-15(26)20-9-4-2-1-3-5-9/h1-8H,(H2,20,23,26)(H,21,22,24)