1-[[(E)-(3-bromanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]-1-tert-butyl-thiourea

Systemtic Name: 1-[[(E)-(3-bromanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]-1-tert-butyl-thiourea Openeye Name: 1-[[(E)-(3-bromo-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]amino]-1-tert-butyl-thiourea CAS Name: 1-[[(E)-(3-bromo-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]-1-tert-butylthiourea IUPAC Name: 1-[[(E)-(3-bromo-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]-1-tert-butylthiourea Traditional Name: 1-[[(E)-(3-bromo-6-keto-cyclohexa-2,4-dien-1-ylidene)methyl]amino]-1-tert-butyl-thiourea Formula: C12H16BrN3OS MolecularWeight: 330.24394

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N(C(=S)N)NC=C1C=C(C=CC1=O)Br

Isomeric SMILES

CC(C)(C)N(C(=S)N)N/C=C/1\C=C(C=CC1=O)Br

InChI

InChI=1S/C12H16BrN3OS/c1-12(2,3)16(11(14)18)15-7-8-6-9(13)4-5-10(8)17/h4-7,15H,1-3H3,(H2,14,18)/b8-7+