N-[(5-chloranylthiophen-2-yl)methyl]-2,3-dimethyl-5-nitro-N-prop-2-enyl-benzenesulfonamide

Systemtic Name: N-[(5-chloranylthiophen-2-yl)methyl]-2,3-dimethyl-5-nitro-N-prop-2-enyl-benzenesulfonamide Openeye Name: N-allyl-N-[(5-chloro-2-thienyl)methyl]-2,3-dimethyl-5-nitro-benzenesulfonamide CAS Name: N-[(5-chloro-2-thiophenyl)methyl]-2,3-dimethyl-5-nitro-N-prop-2-enylbenzenesulfonamide IUPAC Name: N-[(5-chlorothiophen-2-yl)methyl]-2,3-dimethyl-5-nitro-N-prop-2-enylbenzenesulfonamide Traditional Name: N-allyl-N-[(5-chloro-2-thienyl)methyl]-2,3-dimethyl-5-nitro-benzenesulfonamide Formula: C16H17ClN2O4S2 MolecularWeight: 400.90018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)S(=O)(=O)N(CC=C)CC2=CC=C(S2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1C)S(=O)(=O)N(CC=C)CC2=CC=C(S2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H17ClN2O4S2/c1-4-7-18(10-14-5-6-16(17)24-14)25(22,23)15-9-13(19(20)21)8-11(2)12(15)3/h4-6,8-9H,1,7,10H2,2-3H3