1-(4-chloranyl-3-nitro-phenyl)-3-(3-ethoxypropyl)thiourea

Systemtic Name: 1-(4-chloranyl-3-nitro-phenyl)-3-(3-ethoxypropyl)thiourea Openeye Name: 1-(4-chloro-3-nitro-phenyl)-3-(3-ethoxypropyl)thiourea CAS Name: 1-(4-chloro-3-nitrophenyl)-3-(3-ethoxypropyl)thiourea IUPAC Name: 1-(4-chloro-3-nitrophenyl)-3-(3-ethoxypropyl)thiourea Traditional Name: 1-(4-chloro-3-nitro-phenyl)-3-(3-ethoxypropyl)thiourea Formula: C12H16ClN3O3S MolecularWeight: 317.79174

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=S)NC1=CC(=C(C=C1)Cl)[N+](=O)[O-]

Isomeric SMILES

CCOCCCNC(=S)NC1=CC(=C(C=C1)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H16ClN3O3S/c1-2-19-7-3-6-14-12(20)15-9-4-5-10(13)11(8-9)16(17)18/h4-5,8H,2-3,6-7H2,1H3,(H2,14,15,20)