1-[(E)-(3-nitro-4-propan-2-yl-phenyl)methylideneamino]thiourea

Systemtic Name: 1-[(E)-(3-nitro-4-propan-2-yl-phenyl)methylideneamino]thiourea Openeye Name: [(E)-(4-isopropyl-3-nitro-phenyl)methyleneamino]thiourea CAS Name: [(E)-(3-nitro-4-propan-2-ylphenyl)methylideneamino]thiourea IUPAC Name: [(E)-(3-nitro-4-propan-2-ylphenyl)methylideneamino]thiourea Traditional Name: [(E)-(4-isopropyl-3-nitro-benzylidene)amino]thiourea Formula: C11H14N4O2S MolecularWeight: 266.31946

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14N4O2S/c1-7(2)9-4-3-8(5-10(9)15(16)17)6-13-14-11(12)18/h3-7H,1-2H3,(H3,12,14,18)/b13-6+