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

Systemtic Name: 1-[3-(4-chloranylphenoxy)-5-nitro-phenyl]-3-methyl-thiourea Openeye Name: 1-[3-(4-chlorophenoxy)-5-nitro-phenyl]-3-methyl-thiourea CAS Name: 1-[3-(4-chlorophenoxy)-5-nitrophenyl]-3-methylthiourea IUPAC Name: 1-[3-(4-chlorophenoxy)-5-nitrophenyl]-3-methylthiourea Traditional Name: 1-[3-(4-chlorophenoxy)-5-nitro-phenyl]-3-methyl-thiourea Formula: C14H12ClN3O3S MolecularWeight: 337.78138

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NC1=CC(=CC(=C1)OC2=CC=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CNC(=S)NC1=CC(=CC(=C1)OC2=CC=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H12ClN3O3S/c1-16-14(22)17-10-6-11(18(19)20)8-13(7-10)21-12-4-2-9(15)3-5-12/h2-8H,1H3,(H2,16,17,22)