N-(azepan-1-yl)-1-[2-(5-nitrofuran-2-yl)-1,3-thiazol-4-yl]methanimine

Systemtic Name: N-(azepan-1-yl)-1-[2-(5-nitrofuran-2-yl)-1,3-thiazol-4-yl]methanimine Openeye Name: N-(azepan-1-yl)-1-[2-(5-nitro-2-furyl)thiazol-4-yl]methanimine CAS Name: N-(1-azepanyl)-1-[2-(5-nitro-2-furanyl)-4-thiazolyl]methanimine IUPAC Name: N-(azepan-1-yl)-1-[2-(5-nitrofuran-2-yl)-1,3-thiazol-4-yl]methanimine Traditional Name: (E)-azepan-1-yl-[[2-(5-nitro-2-furyl)thiazol-4-yl]methylene]amine Formula: C14H16N4O3S MolecularWeight: 320.36684

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)N=CC2=CSC(=N2)C3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)/N=C/C2=CSC(=N2)C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C14H16N4O3S/c19-18(20)13-6-5-12(21-13)14-16-11(10-22-14)9-15-17-7-3-1-2-4-8-17/h5-6,9-10H,1-4,7-8H2/b15-9+