1-(1-chloranylpropyl)-3-(4-methylphenyl)sulfonyl-1-(2-nitrophenyl)urea

Systemtic Name: 1-(1-chloranylpropyl)-3-(4-methylphenyl)sulfonyl-1-(2-nitrophenyl)urea Openeye Name: 1-(1-chloropropyl)-1-(2-nitrophenyl)-3-(p-tolylsulfonyl)urea CAS Name: 1-(1-chloropropyl)-3-(4-methylphenyl)sulfonyl-1-(2-nitrophenyl)urea IUPAC Name: 1-(1-chloropropyl)-3-(4-methylphenyl)sulfonyl-1-(2-nitrophenyl)urea Traditional Name: 1-(1-chloropropyl)-1-(2-nitrophenyl)-3-tosyl-urea Formula: C17H18ClN3O5S MolecularWeight: 411.85992

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Descriptors Computed from Structure

Canonical SMILES:

CCC(N(C1=CC=CC=C1[N+](=O)[O-])C(=O)NS(=O)(=O)C2=CC=C(C=C2)C)Cl

Isomeric SMILES

CCC(N(C1=CC=CC=C1[N+](=O)[O-])C(=O)NS(=O)(=O)C2=CC=C(C=C2)C)Cl

InChI

InChI=1S/C17H18ClN3O5S/c1-3-16(18)20(14-6-4-5-7-15(14)21(23)24)17(22)19-27(25,26)13-10-8-12(2)9-11-13/h4-11,16H,3H2,1-2H3,(H,19,22)