1-[(6-oxidanylidene-4-propoxy-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-[2-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-[(6-oxidanylidene-4-propoxy-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-[2-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-[(6-oxo-4-propoxy-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-[2-(trifluoromethyl)phenyl]thiourea CAS Name: 1-[(6-oxo-4-propoxy-1-cyclohexa-2,4-dienylidene)methylamino]-3-[2-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-[(6-oxo-4-propoxycyclohexa-2,4-dien-1-ylidene)methylamino]-3-[2-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-[(6-keto-4-propoxy-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-[2-(trifluoromethyl)phenyl]thiourea Formula: C18H18F3N3O2S MolecularWeight: 397.41463

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=O)C(=CNNC(=S)NC2=CC=CC=C2C(F)(F)F)C=C1

Isomeric SMILES

CCCOC1=CC(=O)C(=CNNC(=S)NC2=CC=CC=C2C(F)(F)F)C=C1

InChI

InChI=1S/C18H18F3N3O2S/c1-2-9-26-13-8-7-12(16(25)10-13)11-22-24-17(27)23-15-6-4-3-5-14(15)18(19,20)21/h3-8,10-11,22H,2,9H2,1H3,(H2,23,24,27)