1-[(3-bromophenyl)methyl]-3-(2-methoxy-4-nitro-phenyl)thiourea

Systemtic Name: 1-[(3-bromophenyl)methyl]-3-(2-methoxy-4-nitro-phenyl)thiourea Openeye Name: 1-[(3-bromophenyl)methyl]-3-(2-methoxy-4-nitro-phenyl)thiourea CAS Name: 1-[(3-bromophenyl)methyl]-3-(2-methoxy-4-nitrophenyl)thiourea IUPAC Name: 1-[(3-bromophenyl)methyl]-3-(2-methoxy-4-nitrophenyl)thiourea Traditional Name: 1-(3-bromobenzyl)-3-(2-methoxy-4-nitro-phenyl)thiourea Formula: C15H14BrN3O3S MolecularWeight: 396.25896

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H14BrN3O3S/c1-22-14-8-12(19(20)21)5-6-13(14)18-15(23)17-9-10-3-2-4-11(16)7-10/h2-8H,9H2,1H3,(H2,17,18,23)