1-[(Z)-[3-chloranyl-4-(cyanomethoxy)-5-ethoxy-phenyl]methylideneamino]thiourea

Systemtic Name: 1-[(Z)-[3-chloranyl-4-(cyanomethoxy)-5-ethoxy-phenyl]methylideneamino]thiourea Openeye Name: [(Z)-[3-chloro-4-(cyanomethoxy)-5-ethoxy-phenyl]methyleneamino]thiourea CAS Name: [(Z)-[3-chloro-4-(cyanomethoxy)-5-ethoxyphenyl]methylideneamino]thiourea IUPAC Name: [(Z)-[3-chloro-4-(cyanomethoxy)-5-ethoxyphenyl]methylideneamino]thiourea Traditional Name: [(Z)-[3-chloro-4-(cyanomethoxy)-5-ethoxy-benzylidene]amino]thiourea Formula: C12H13ClN4O2S MolecularWeight: 312.77522

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=NNC(=S)N)Cl)OCC#N

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=N\NC(=S)N)Cl)OCC#N

InChI

InChI=1S/C12H13ClN4O2S/c1-2-18-10-6-8(7-16-17-12(15)20)5-9(13)11(10)19-4-3-14/h5-7H,2,4H2,1H3,(H3,15,17,20)/b16-7-