1-[[(E)-(3-bromanyl-2-chloranyl-5-ethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]amino]thiourea

Systemtic Name: 1-[[(E)-(3-bromanyl-2-chloranyl-5-ethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]amino]thiourea Openeye Name: [[(E)-(3-bromo-2-chloro-5-ethoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]amino]thiourea CAS Name: [[(E)-(3-bromo-2-chloro-5-ethoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]amino]thiourea IUPAC Name: [[(E)-(3-bromo-2-chloro-5-ethoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]amino]thiourea Traditional Name: [[(E)-(3-bromo-2-chloro-5-ethoxy-4-keto-cyclohexa-2,5-dien-1-ylidene)methyl]amino]thiourea Formula: C10H11BrClN3O2S MolecularWeight: 352.63524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CNNC(=S)N)C(=C(C1=O)Br)Cl

Isomeric SMILES

CCOC1=C/C(=C\NNC(=S)N)/C(=C(C1=O)Br)Cl

InChI

InChI=1S/C10H11BrClN3O2S/c1-2-17-6-3-5(4-14-15-10(13)18)8(12)7(11)9(6)16/h3-4,14H,2H2,1H3,(H3,13,15,18)/b5-4+