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

Systemtic Name: 1-[(3-chloranyl-5-ethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-ethyl-thiourea Openeye Name: 1-[(3-chloro-5-ethoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-ethyl-thiourea CAS Name: 1-[(3-chloro-5-ethoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]-3-ethylthiourea IUPAC Name: 1-[(3-chloro-5-ethoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-3-ethylthiourea Traditional Name: 1-[(3-chloro-5-ethoxy-4-keto-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-ethyl-thiourea Formula: C12H16ClN3O2S MolecularWeight: 301.79234

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NNC=C1C=C(C(=O)C(=C1)Cl)OCC

Isomeric SMILES

CCNC(=S)NNC=C1C=C(C(=O)C(=C1)Cl)OCC

InChI

InChI=1S/C12H16ClN3O2S/c1-3-14-12(19)16-15-7-8-5-9(13)11(17)10(6-8)18-4-2/h5-7,15H,3-4H2,1-2H3,(H2,14,16,19)