1-[(Z)-(4-bromanyl-3-nitro-phenyl)methylideneamino]-3-[[(2R)-oxolan-2-yl]methyl]thiourea

Systemtic Name: 1-[(Z)-(4-bromanyl-3-nitro-phenyl)methylideneamino]-3-[[(2R)-oxolan-2-yl]methyl]thiourea Openeye Name: 1-[(Z)-(4-bromo-3-nitro-phenyl)methyleneamino]-3-[[(2R)-tetrahydrofuran-2-yl]methyl]thiourea CAS Name: 1-[(Z)-(4-bromo-3-nitrophenyl)methylideneamino]-3-[[(2R)-2-oxolanyl]methyl]thiourea IUPAC Name: 1-[(Z)-(4-bromo-3-nitrophenyl)methylideneamino]-3-[[(2R)-oxolan-2-yl]methyl]thiourea Traditional Name: 1-[(Z)-(4-bromo-3-nitro-benzylidene)amino]-3-[[(2R)-tetrahydrofuran-2-yl]methyl]thiourea Formula: C13H15BrN4O3S MolecularWeight: 387.2522

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=S)NN=CC2=CC(=C(C=C2)Br)[N+](=O)[O-]

Isomeric SMILES

C1C[C@@H](OC1)CNC(=S)N/N=C\C2=CC(=C(C=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C13H15BrN4O3S/c14-11-4-3-9(6-12(11)18(19)20)7-16-17-13(22)15-8-10-2-1-5-21-10/h3-4,6-7,10H,1-2,5,8H2,(H2,15,17,22)/b16-7-/t10-/m1/s1