N-[4-cyclopentyl-5-(1,2,4-triazol-1-yl)-1,3-thiazol-2-yl]-1-(2-nitrophenyl)methanimine

Systemtic Name: N-[4-cyclopentyl-5-(1,2,4-triazol-1-yl)-1,3-thiazol-2-yl]-1-(2-nitrophenyl)methanimine Openeye Name: N-[4-cyclopentyl-5-(1,2,4-triazol-1-yl)thiazol-2-yl]-1-(2-nitrophenyl)methanimine CAS Name: N-[4-cyclopentyl-5-(1,2,4-triazol-1-yl)-2-thiazolyl]-1-(2-nitrophenyl)methanimine IUPAC Name: N-[4-cyclopentyl-5-(1,2,4-triazol-1-yl)-1,3-thiazol-2-yl]-1-(2-nitrophenyl)methanimine Traditional Name: (E)-[4-cyclopentyl-5-(1,2,4-triazol-1-yl)thiazol-2-yl]-(2-nitrobenzylidene)amine Formula: C17H11N6O2S MolecularWeight: 363.37324

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=NC2=NC(=C(S2)N3C=NC=N3)[C]4[CH][CH][CH][CH]4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)/C=N/C2=NC(=C(S2)N3C=NC=N3)[C]4[CH][CH][CH][CH]4)[N+](=O)[O-]

InChI

InChI=1S/C17H11N6O2S/c24-23(25)14-8-4-3-7-13(14)9-19-17-21-15(12-5-1-2-6-12)16(26-17)22-11-18-10-20-22/h1-11H/b19-9+