1-[(E)-1-(4-chloranyl-3-nitro-phenyl)ethylideneamino]-3-(2-methoxyethyl)thiourea

Systemtic Name: 1-[(E)-1-(4-chloranyl-3-nitro-phenyl)ethylideneamino]-3-(2-methoxyethyl)thiourea Openeye Name: 1-[(E)-1-(4-chloro-3-nitro-phenyl)ethylideneamino]-3-(2-methoxyethyl)thiourea CAS Name: 1-[(E)-1-(4-chloro-3-nitrophenyl)ethylideneamino]-3-(2-methoxyethyl)thiourea IUPAC Name: 1-[(E)-1-(4-chloro-3-nitrophenyl)ethylideneamino]-3-(2-methoxyethyl)thiourea Traditional Name: 1-[(E)-1-(4-chloro-3-nitro-phenyl)ethylideneamino]-3-(2-methoxyethyl)thiourea Formula: C12H15ClN4O3S MolecularWeight: 330.7905

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NCCOC)C1=CC(=C(C=C1)Cl)[N+](=O)[O-]

Isomeric SMILES

C/C(=N\NC(=S)NCCOC)/C1=CC(=C(C=C1)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H15ClN4O3S/c1-8(15-16-12(21)14-5-6-20-2)9-3-4-10(13)11(7-9)17(18)19/h3-4,7H,5-6H2,1-2H3,(H2,14,16,21)/b15-8+