5-[4-[(5-nitrofuran-2-yl)methylideneamino]phenyl]-N-(phenylmethyl)-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[4-[(5-nitrofuran-2-yl)methylideneamino]phenyl]-N-(phenylmethyl)-1,3,4-thiadiazol-2-amine Openeye Name: N-benzyl-5-[4-[(5-nitro-2-furyl)methyleneamino]phenyl]-1,3,4-thiadiazol-2-amine CAS Name: 5-[4-[(5-nitro-2-furanyl)methylideneamino]phenyl]-N-(phenylmethyl)-1,3,4-thiadiazol-2-amine IUPAC Name: N-benzyl-5-[4-[(5-nitrofuran-2-yl)methylideneamino]phenyl]-1,3,4-thiadiazol-2-amine Traditional Name: benzyl-[5-[4-[(5-nitro-2-furyl)methyleneamino]phenyl]-1,3,4-thiadiazol-2-yl]amine Formula: C20H15N5O3S MolecularWeight: 405.4298

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NN=C(S2)C3=CC=C(C=C3)N=CC4=CC=C(O4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NN=C(S2)C3=CC=C(C=C3)N=CC4=CC=C(O4)[N+](=O)[O-]

InChI

InChI=1S/C20H15N5O3S/c26-25(27)18-11-10-17(28-18)13-21-16-8-6-15(7-9-16)19-23-24-20(29-19)22-12-14-4-2-1-3-5-14/h1-11,13H,12H2,(H,22,24)