1-ethyl-3-[[4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]methylideneamino]thiourea

Systemtic Name: 1-ethyl-3-[[4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]methylideneamino]thiourea Openeye Name: 1-ethyl-3-[[4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]methyleneamino]thiourea CAS Name: 1-ethyl-3-[[4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]methylideneamino]thiourea IUPAC Name: 1-ethyl-3-[[4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]methylideneamino]thiourea Traditional Name: 1-ethyl-3-[[4-[2-nitro-4-(trifluoromethyl)phenoxy]benzylidene]amino]thiourea Formula: C17H15F3N4O3S MolecularWeight: 412.38621

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NN=CC1=CC=C(C=C1)OC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCNC(=S)NN=CC1=CC=C(C=C1)OC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C17H15F3N4O3S/c1-2-21-16(28)23-22-10-11-3-6-13(7-4-11)27-15-8-5-12(17(18,19)20)9-14(15)24(25)26/h3-10H,2H2,1H3,(H2,21,23,28)