1-(4-nitrophenyl)-3-(4-phenoxybutyl)thiourea

Systemtic Name: 1-(4-nitrophenyl)-3-(4-phenoxybutyl)thiourea Openeye Name: 1-(4-nitrophenyl)-3-(4-phenoxybutyl)thiourea CAS Name: 1-(4-nitrophenyl)-3-(4-phenoxybutyl)thiourea IUPAC Name: 1-(4-nitrophenyl)-3-(4-phenoxybutyl)thiourea Traditional Name: 1-(4-nitrophenyl)-3-(4-phenoxybutyl)thiourea Formula: C17H19N3O3S MolecularWeight: 345.41606

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCCCNC(=S)NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OCCCCNC(=S)NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O3S/c21-20(22)15-10-8-14(9-11-15)19-17(24)18-12-4-5-13-23-16-6-2-1-3-7-16/h1-3,6-11H,4-5,12-13H2,(H2,18,19,24)