1-(3-imidazol-1-ylpropyl)-3-(4-nitrophenyl)thiourea

Systemtic Name: 1-(3-imidazol-1-ylpropyl)-3-(4-nitrophenyl)thiourea Openeye Name: 1-(3-imidazol-1-ylpropyl)-3-(4-nitrophenyl)thiourea CAS Name: 1-[3-(1-imidazolyl)propyl]-3-(4-nitrophenyl)thiourea IUPAC Name: 1-(3-imidazol-1-ylpropyl)-3-(4-nitrophenyl)thiourea Traditional Name: 1-(3-imidazol-1-ylpropyl)-3-(4-nitrophenyl)thiourea Formula: C13H15N5O2S MolecularWeight: 305.3555

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=S)NCCCN2C=CN=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NC(=S)NCCCN2C=CN=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H15N5O2S/c19-18(20)12-4-2-11(3-5-12)16-13(21)15-6-1-8-17-9-7-14-10-17/h2-5,7,9-10H,1,6,8H2,(H2,15,16,21)