1-[(4-oxidanylidene-4-phenyl-butanoyl)amino]-3-[2-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-[(4-oxidanylidene-4-phenyl-butanoyl)amino]-3-[2-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-[(4-oxo-4-phenyl-butanoyl)amino]-3-[2-(trifluoromethyl)phenyl]thiourea CAS Name: 1-[(1,4-dioxo-4-phenylbutyl)amino]-3-[2-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-[(4-oxo-4-phenylbutanoyl)amino]-3-[2-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-[(4-keto-4-phenyl-butanoyl)amino]-3-[2-(trifluoromethyl)phenyl]thiourea Formula: C18H16F3N3O2S MolecularWeight: 395.39875

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CCC(=O)NNC(=S)NC2=CC=CC=C2C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CCC(=O)NNC(=S)NC2=CC=CC=C2C(F)(F)F

InChI

InChI=1S/C18H16F3N3O2S/c19-18(20,21)13-8-4-5-9-14(13)22-17(27)24-23-16(26)11-10-15(25)12-6-2-1-3-7-12/h1-9H,10-11H2,(H,23,26)(H2,22,24,27)