3-(4-butoxy-3-nitro-phenyl)-6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazol-4-ium

Systemtic Name: 3-(4-butoxy-3-nitro-phenyl)-6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazol-4-ium Openeye Name: 3-(4-butoxy-3-nitro-phenyl)-6,7-dihydro-5H-imidazo[2,1-b]thiazol-4-ium CAS Name: 3-(4-butoxy-3-nitrophenyl)-6,7-dihydro-5H-imidazo[2,1-b]thiazol-4-ium IUPAC Name: 3-(4-butoxy-3-nitrophenyl)-6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazol-4-ium Traditional Name: 3-(4-butoxy-3-nitro-phenyl)-6,7-dihydro-5H-imidazo[2,1-b]thiazol-4-ium Formula: C15H18N3O3S+ MolecularWeight: 320.38672

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C2=CSC3=[N+]2CCN3)[N+](=O)[O-]

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C2=CSC3=[N+]2CCN3)[N+](=O)[O-]

InChI

InChI=1S/C15H17N3O3S/c1-2-3-8-21-14-5-4-11(9-12(14)18(19)20)13-10-22-15-16-6-7-17(13)15/h4-5,9-10H,2-3,6-8H2,1H3/p+1