4-nitrobicyclo[3.1.0]hexa-1(6),2,4-triene; 1-oxidanyl-3-phenyl-thiourea

Systemtic Name: 4-nitrobicyclo[3.1.0]hexa-1(6),2,4-triene; 1-oxidanyl-3-phenyl-thiourea Openeye Name: 1-hydroxy-3-phenyl-thiourea; 4-nitrobicyclo[3.1.0]hexa-1(6),2,4-triene CAS Name: 1-hydroxy-3-phenylthiourea; 4-nitrobicyclo[3.1.0]hexa-1(6),2,4-triene IUPAC Name: 1-hydroxy-3-phenylthiourea; 4-nitrobicyclo[3.1.0]hexa-1(6),2,4-triene Traditional Name: 1-hydroxy-3-phenyl-thiourea; 4-nitrobicyclo[3.1.0]hexa-1(6),2,4-triene Formula: C13H11N3O3S MolecularWeight: 289.30974

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NO.C1=CC(=C2C1=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NO.C1=CC(=C2C1=C2)[N+](=O)[O-]

InChI

InChI=1S/C7H8N2OS.C6H3NO2/c10-9-7(11)8-6-4-2-1-3-5-6;8-7(9)6-2-1-4-3-5(4)6/h1-5,10H,(H2,8,9,11);1-3H