1-[3-(4-chloranylphenoxy)-5-nitro-phenyl]-3-cyclopentyl-thiourea

Systemtic Name: 1-[3-(4-chloranylphenoxy)-5-nitro-phenyl]-3-cyclopentyl-thiourea Openeye Name: 1-[3-(4-chlorophenoxy)-5-nitro-phenyl]-3-cyclopentyl-thiourea CAS Name: 1-[3-(4-chlorophenoxy)-5-nitrophenyl]-3-cyclopentylthiourea IUPAC Name: 1-[3-(4-chlorophenoxy)-5-nitrophenyl]-3-cyclopentylthiourea Traditional Name: 1-[3-(4-chlorophenoxy)-5-nitro-phenyl]-3-cyclopentyl-thiourea Formula: C18H18ClN3O3S MolecularWeight: 391.87182

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=S)NC2=CC(=CC(=C2)OC3=CC=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCC(C1)NC(=S)NC2=CC(=CC(=C2)OC3=CC=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H18ClN3O3S/c19-12-5-7-16(8-6-12)25-17-10-14(9-15(11-17)22(23)24)21-18(26)20-13-3-1-2-4-13/h5-11,13H,1-4H2,(H2,20,21,26)