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

Systemtic Name: 1-(3-bromophenyl)-3-(2-methoxy-4-nitro-phenyl)thiourea Openeye Name: 1-(3-bromophenyl)-3-(2-methoxy-4-nitro-phenyl)thiourea CAS Name: 1-(3-bromophenyl)-3-(2-methoxy-4-nitrophenyl)thiourea IUPAC Name: 1-(3-bromophenyl)-3-(2-methoxy-4-nitrophenyl)thiourea Traditional Name: 1-(3-bromophenyl)-3-(2-methoxy-4-nitro-phenyl)thiourea Formula: C14H12BrN3O3S MolecularWeight: 382.23238

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NC2=CC(=CC=C2)Br

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NC2=CC(=CC=C2)Br

InChI

InChI=1S/C14H12BrN3O3S/c1-21-13-8-11(18(19)20)5-6-12(13)17-14(22)16-10-4-2-3-9(15)7-10/h2-8H,1H3,(H2,16,17,22)