1-[(5-chloranyl-2-methoxy-phenyl)methyl]-3-(2-chloranyl-5-nitro-phenyl)-1-methyl-thiourea

Systemtic Name: 1-[(5-chloranyl-2-methoxy-phenyl)methyl]-3-(2-chloranyl-5-nitro-phenyl)-1-methyl-thiourea Openeye Name: 1-[(5-chloro-2-methoxy-phenyl)methyl]-3-(2-chloro-5-nitro-phenyl)-1-methyl-thiourea CAS Name: 1-[(5-chloro-2-methoxyphenyl)methyl]-3-(2-chloro-5-nitrophenyl)-1-methylthiourea IUPAC Name: 1-[(5-chloro-2-methoxyphenyl)methyl]-3-(2-chloro-5-nitrophenyl)-1-methylthiourea Traditional Name: 1-(5-chloro-2-methoxy-benzyl)-3-(2-chloro-5-nitro-phenyl)-1-methyl-thiourea Formula: C16H15Cl2N3O3S MolecularWeight: 400.2796

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC(=C1)Cl)OC)C(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CN(CC1=C(C=CC(=C1)Cl)OC)C(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H15Cl2N3O3S/c1-20(9-10-7-11(17)3-6-15(10)24-2)16(25)19-14-8-12(21(22)23)4-5-13(14)18/h3-8H,9H2,1-2H3,(H,19,25)