N-(2-methylsulfanylphenyl)-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline

Systemtic Name: N-(2-methylsulfanylphenyl)-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline Openeye Name: N-(2-methylsulfanylphenyl)-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline CAS Name: N-[2-(methylthio)phenyl]-2-nitro-4-(1-pyrrolidinylsulfonyl)aniline IUPAC Name: N-(2-methylsulfanylphenyl)-2-nitro-4-pyrrolidin-1-ylsulfonylaniline Traditional Name: [2-(methylthio)phenyl]-(2-nitro-4-pyrrolidinosulfonyl-phenyl)amine Formula: C17H19N3O4S2 MolecularWeight: 393.48046

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CSC1=CC=CC=C1NC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O4S2/c1-25-17-7-3-2-6-15(17)18-14-9-8-13(12-16(14)20(21)22)26(23,24)19-10-4-5-11-19/h2-3,6-9,12,18H,4-5,10-11H2,1H3