1-butyl-3-[(Z)-(3-nitrophenyl)methylideneamino]thiourea

Systemtic Name: 1-butyl-3-[(Z)-(3-nitrophenyl)methylideneamino]thiourea Openeye Name: 1-butyl-3-[(Z)-(3-nitrophenyl)methyleneamino]thiourea CAS Name: 1-butyl-3-[(Z)-(3-nitrophenyl)methylideneamino]thiourea IUPAC Name: 1-butyl-3-[(Z)-(3-nitrophenyl)methylideneamino]thiourea Traditional Name: 1-butyl-3-[(Z)-(3-nitrobenzylidene)amino]thiourea Formula: C12H16N4O2S MolecularWeight: 280.34604

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NN=CC1=CC(=CC=C1)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C12H16N4O2S/c1-2-3-7-13-12(19)15-14-9-10-5-4-6-11(8-10)16(17)18/h4-6,8-9H,2-3,7H2,1H3,(H2,13,15,19)/b14-9-