1-[[2,3-bis(bromanyl)-5-ethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene]methylamino]-3-ethyl-thiourea

Systemtic Name: 1-[[2,3-bis(bromanyl)-5-ethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene]methylamino]-3-ethyl-thiourea Openeye Name: 1-[(2,3-dibromo-5-ethoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-ethyl-thiourea CAS Name: 1-[(2,3-dibromo-5-ethoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]-3-ethylthiourea IUPAC Name: 1-[(2,3-dibromo-5-ethoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-3-ethylthiourea Traditional Name: 1-[(2,3-dibromo-5-ethoxy-4-keto-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-ethyl-thiourea Formula: C12H15Br2N3O2S MolecularWeight: 425.1394

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NNC=C1C=C(C(=O)C(=C1Br)Br)OCC

Isomeric SMILES

CCNC(=S)NNC=C1C=C(C(=O)C(=C1Br)Br)OCC

InChI

InChI=1S/C12H15Br2N3O2S/c1-3-15-12(20)17-16-6-7-5-8(19-4-2)11(18)10(14)9(7)13/h5-6,16H,3-4H2,1-2H3,(H2,15,17,20)