1-(4-bromophenyl)-3-[[(E)-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methyl]amino]thiourea

Systemtic Name: 1-(4-bromophenyl)-3-[[(E)-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methyl]amino]thiourea Openeye Name: 1-(4-bromophenyl)-3-[[(E)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]thiourea CAS Name: 1-(4-bromophenyl)-3-[[(E)-(6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]thiourea IUPAC Name: 1-(4-bromophenyl)-3-[[(E)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]thiourea Traditional Name: 1-(4-bromophenyl)-3-[[(E)-(6-ketocyclohexa-2,4-dien-1-ylidene)methyl]amino]thiourea Formula: C14H12BrN3OS MolecularWeight: 350.23358

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CNNC(=S)NC2=CC=C(C=C2)Br)C(=O)C=C1

Isomeric SMILES

C1=C/C(=C\NNC(=S)NC2=CC=C(C=C2)Br)/C(=O)C=C1

InChI

InChI=1S/C14H12BrN3OS/c15-11-5-7-12(8-6-11)17-14(20)18-16-9-10-3-1-2-4-13(10)19/h1-9,16H,(H2,17,18,20)/b10-9+