methyl N'-[[3,5-bis(bromanyl)-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]methylamino]carbamimidothioate

Systemtic Name: methyl N'-[[3,5-bis(bromanyl)-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]methylamino]carbamimidothioate Openeye Name: 3-[(3,5-dibromo-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]-2-methyl-isothiourea CAS Name: N'-[(3,5-dibromo-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]carbamimidothioic acid methyl ester IUPAC Name: methyl N'-[(3,5-dibromo-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]carbamimidothioate Traditional Name: 3-[(3,5-dibromo-6-keto-cyclohexa-2,4-dien-1-ylidene)methylamino]-2-methyl-isothiourea Formula: C9H9Br2N3OS MolecularWeight: 367.06026

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NNC=C1C=C(C=C(C1=O)Br)Br)N

Isomeric SMILES

CS/C(=N/NC=C1C=C(C=C(C1=O)Br)Br)/N

InChI

InChI=1S/C9H9Br2N3OS/c1-16-9(12)14-13-4-5-2-6(10)3-7(11)8(5)15/h2-4,13H,1H3,(H2,12,14)