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

Systemtic Name: 1-[(3-bromanyl-5-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-[(4-fluorophenyl)methyl]thiourea Openeye Name: 1-[(3-bromo-5-methoxy-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-[(4-fluorophenyl)methyl]thiourea CAS Name: 1-[(3-bromo-5-methoxy-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-3-[(4-fluorophenyl)methyl]thiourea IUPAC Name: 1-[(3-bromo-5-methoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-3-[(4-fluorophenyl)methyl]thiourea Traditional Name: 1-[(3-bromo-6-keto-5-methoxy-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-(4-fluorobenzyl)thiourea Formula: C16H15BrFN3O2S MolecularWeight: 412.276603

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=CNNC(=S)NCC2=CC=C(C=C2)F)C1=O)Br

Isomeric SMILES

COC1=CC(=CC(=CNNC(=S)NCC2=CC=C(C=C2)F)C1=O)Br

InChI

InChI=1S/C16H15BrFN3O2S/c1-23-14-7-12(17)6-11(15(14)22)9-20-21-16(24)19-8-10-2-4-13(18)5-3-10/h2-7,9,20H,8H2,1H3,(H2,19,21,24)