3-(2-chloranyl-5-nitro-phenyl)-1-[2-(4-methoxyphenoxy)ethyl]-1-methyl-thiourea

Systemtic Name: 3-(2-chloranyl-5-nitro-phenyl)-1-[2-(4-methoxyphenoxy)ethyl]-1-methyl-thiourea Openeye Name: 3-(2-chloro-5-nitro-phenyl)-1-[2-(4-methoxyphenoxy)ethyl]-1-methyl-thiourea CAS Name: 3-(2-chloro-5-nitrophenyl)-1-[2-(4-methoxyphenoxy)ethyl]-1-methylthiourea IUPAC Name: 3-(2-chloro-5-nitrophenyl)-1-[2-(4-methoxyphenoxy)ethyl]-1-methylthiourea Traditional Name: 3-(2-chloro-5-nitro-phenyl)-1-[2-(4-methoxyphenoxy)ethyl]-1-methyl-thiourea Formula: C17H18ClN3O4S MolecularWeight: 395.86052

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCOC1=CC=C(C=C1)OC)C(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CN(CCOC1=CC=C(C=C1)OC)C(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H18ClN3O4S/c1-20(9-10-25-14-6-4-13(24-2)5-7-14)17(26)19-16-11-12(21(22)23)3-8-15(16)18/h3-8,11H,9-10H2,1-2H3,(H,19,26)