1-[(5-ethoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-[(4-fluorophenyl)methyl]thiourea

Systemtic Name: 1-[(5-ethoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-[(4-fluorophenyl)methyl]thiourea Openeye Name: 1-[(5-ethoxy-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-[(4-fluorophenyl)methyl]thiourea CAS Name: 1-[(5-ethoxy-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-3-[(4-fluorophenyl)methyl]thiourea IUPAC Name: 1-[(5-ethoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-3-[(4-fluorophenyl)methyl]thiourea Traditional Name: 1-[(5-ethoxy-6-keto-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-(4-fluorobenzyl)thiourea Formula: C17H18FN3O2S MolecularWeight: 347.407123

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=CNNC(=S)NCC2=CC=C(C=C2)F)C1=O

Isomeric SMILES

CCOC1=CC=CC(=CNNC(=S)NCC2=CC=C(C=C2)F)C1=O

InChI

InChI=1S/C17H18FN3O2S/c1-2-23-15-5-3-4-13(16(15)22)11-20-21-17(24)19-10-12-6-8-14(18)9-7-12/h3-9,11,20H,2,10H2,1H3,(H2,19,21,24)