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

Systemtic Name: 1-[4-[(3-bromanyl-5-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]thiourea Openeye Name: [4-[(3-bromo-5-methoxy-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]thiourea CAS Name: [4-[(3-bromo-5-methoxy-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]phenyl]thiourea IUPAC Name: [4-[(3-bromo-5-methoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]thiourea Traditional Name: [4-[(3-bromo-6-keto-5-methoxy-cyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]thiourea Formula: C15H14BrN3O2S MolecularWeight: 380.25956

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=CNC2=CC=C(C=C2)NC(=S)N)C1=O)Br

Isomeric SMILES

COC1=CC(=CC(=CNC2=CC=C(C=C2)NC(=S)N)C1=O)Br

InChI

InChI=1S/C15H14BrN3O2S/c1-21-13-7-10(16)6-9(14(13)20)8-18-11-2-4-12(5-3-11)19-15(17)22/h2-8,18H,1H3,(H3,17,19,22)