1-[(E)-(2-nitro-3-propyl-imidazol-4-yl)methylideneamino]thiourea

Systemtic Name: 1-[(E)-(2-nitro-3-propyl-imidazol-4-yl)methylideneamino]thiourea Openeye Name: [(E)-(2-nitro-3-propyl-imidazol-4-yl)methyleneamino]thiourea CAS Name: [(E)-(2-nitro-3-propyl-4-imidazolyl)methylideneamino]thiourea IUPAC Name: [(E)-(2-nitro-3-propylimidazol-4-yl)methylideneamino]thiourea Traditional Name: [(E)-(2-nitro-3-propyl-imidazol-4-yl)methyleneamino]thiourea Formula: C8H12N6O2S MolecularWeight: 256.28488

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CN=C1[N+](=O)[O-])C=NNC(=S)N

Isomeric SMILES

CCCN1C(=CN=C1[N+](=O)[O-])/C=N/NC(=S)N

InChI

InChI=1S/C8H12N6O2S/c1-2-3-13-6(5-11-12-7(9)17)4-10-8(13)14(15)16/h4-5H,2-3H2,1H3,(H3,9,12,17)/b11-5+