1-(4-methoxyphenyl)-3-[(5-nitro-2-oxidanyl-phenyl)methyl]thiourea

Systemtic Name: 1-(4-methoxyphenyl)-3-[(5-nitro-2-oxidanyl-phenyl)methyl]thiourea Openeye Name: 1-[(2-hydroxy-5-nitro-phenyl)methyl]-3-(4-methoxyphenyl)thiourea CAS Name: 1-[(2-hydroxy-5-nitrophenyl)methyl]-3-(4-methoxyphenyl)thiourea IUPAC Name: 1-[(2-hydroxy-5-nitrophenyl)methyl]-3-(4-methoxyphenyl)thiourea Traditional Name: 1-(2-hydroxy-5-nitro-benzyl)-3-(4-methoxyphenyl)thiourea Formula: C15H15N3O4S MolecularWeight: 333.3623

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=S)NCC2=C(C=CC(=C2)[N+](=O)[O-])O

Isomeric SMILES

COC1=CC=C(C=C1)NC(=S)NCC2=C(C=CC(=C2)[N+](=O)[O-])O

InChI

InChI=1S/C15H15N3O4S/c1-22-13-5-2-11(3-6-13)17-15(23)16-9-10-8-12(18(20)21)4-7-14(10)19/h2-8,19H,9H2,1H3,(H2,16,17,23)