2-methyl-4-[(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)methyl]-1,3-thiazole

Systemtic Name: 2-methyl-4-[(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)methyl]-1,3-thiazole Openeye Name: 2-methyl-4-[(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)methyl]thiazole CAS Name: 2-methyl-4-[[2-nitro-4-(1-pyrrolidinylsulfonyl)phenoxy]methyl]thiazole IUPAC Name: 2-methyl-4-[(2-nitro-4-pyrrolidin-1-ylsulfonylphenoxy)methyl]-1,3-thiazole Traditional Name: 2-methyl-4-[(2-nitro-4-pyrrolidinosulfonyl-phenoxy)methyl]thiazole Formula: C15H17N3O5S2 MolecularWeight: 383.44258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)COC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=CS1)COC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C15H17N3O5S2/c1-11-16-12(10-24-11)9-23-15-5-4-13(8-14(15)18(19)20)25(21,22)17-6-2-3-7-17/h4-5,8,10H,2-3,6-7,9H2,1H3