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

Systemtic Name: 1-[(3-bromanyl-5-nitro-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-ethyl-thiourea Openeye Name: 1-[(3-bromo-5-nitro-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-ethyl-thiourea CAS Name: 1-[(3-bromo-5-nitro-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]-3-ethylthiourea IUPAC Name: 1-[(3-bromo-5-nitro-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-3-ethylthiourea Traditional Name: 1-[(3-bromo-4-keto-5-nitro-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-ethyl-thiourea Formula: C10H11BrN4O3S MolecularWeight: 347.18834

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NNC=C1C=C(C(=O)C(=C1)Br)[N+](=O)[O-]

Isomeric SMILES

CCNC(=S)NNC=C1C=C(C(=O)C(=C1)Br)[N+](=O)[O-]

InChI

InChI=1S/C10H11BrN4O3S/c1-2-12-10(19)14-13-5-6-3-7(11)9(16)8(4-6)15(17)18/h3-5,13H,2H2,1H3,(H2,12,14,19)