1-(4-methylphenyl)-3-[[2-oxidanylidene-5-(trifluoromethyloxy)indol-3-yl]amino]thiourea

Systemtic Name: 1-(4-methylphenyl)-3-[[2-oxidanylidene-5-(trifluoromethyloxy)indol-3-yl]amino]thiourea Openeye Name: 1-[[2-oxo-5-(trifluoromethoxy)indol-3-yl]amino]-3-(p-tolyl)thiourea CAS Name: 1-(4-methylphenyl)-3-[[2-oxo-5-(trifluoromethoxy)-3-indolyl]amino]thiourea IUPAC Name: 1-(4-methylphenyl)-3-[[2-oxo-5-(trifluoromethoxy)indol-3-yl]amino]thiourea Traditional Name: 1-[[2-keto-5-(trifluoromethoxy)indol-3-yl]amino]-3-(p-tolyl)thiourea Formula: C17H13F3N4O2S MolecularWeight: 394.37093

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)NNC2=C3C=C(C=CC3=NC2=O)OC(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)NNC2=C3C=C(C=CC3=NC2=O)OC(F)(F)F

InChI

InChI=1S/C17H13F3N4O2S/c1-9-2-4-10(5-3-9)21-16(27)24-23-14-12-8-11(26-17(18,19)20)6-7-13(12)22-15(14)25/h2-8H,1H3,(H2,21,24,27)(H,22,23,25)