1-[(Z)-(4-bromanyl-3-nitro-phenyl)methylideneamino]-3-butyl-thiourea

Systemtic Name: 1-[(Z)-(4-bromanyl-3-nitro-phenyl)methylideneamino]-3-butyl-thiourea Openeye Name: 1-[(Z)-(4-bromo-3-nitro-phenyl)methyleneamino]-3-butyl-thiourea CAS Name: 1-[(Z)-(4-bromo-3-nitrophenyl)methylideneamino]-3-butylthiourea IUPAC Name: 1-[(Z)-(4-bromo-3-nitrophenyl)methylideneamino]-3-butylthiourea Traditional Name: 1-[(Z)-(4-bromo-3-nitro-benzylidene)amino]-3-butyl-thiourea Formula: C12H15BrN4O2S MolecularWeight: 359.2421

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15BrN4O2S/c1-2-3-6-14-12(20)16-15-8-9-4-5-10(13)11(7-9)17(18)19/h4-5,7-8H,2-3,6H2,1H3,(H2,14,16,20)/b15-8-