3-chloranyl-N-[3-(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)phenyl]-4-methyl-5-nitro-benzenesulfonamide

Systemtic Name: 3-chloranyl-N-[3-(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)phenyl]-4-methyl-5-nitro-benzenesulfonamide Openeye Name: 3-chloro-N-[3-(1-cyclopropyltetrazol-5-yl)phenyl]-4-methyl-5-nitro-benzenesulfonamide CAS Name: 3-chloro-N-[3-(1-cyclopropyl-5-tetrazolyl)phenyl]-4-methyl-5-nitrobenzenesulfonamide IUPAC Name: 3-chloro-N-[3-(1-cyclopropyltetrazol-5-yl)phenyl]-4-methyl-5-nitrobenzenesulfonamide Traditional Name: 3-chloro-N-[3-(1-cyclopropyltetrazol-5-yl)phenyl]-4-methyl-5-nitro-benzenesulfonamide Formula: C17H15ClN6O4S MolecularWeight: 434.8568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)NC2=CC=CC(=C2)C3=NN=NN3C4CC4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)NC2=CC=CC(=C2)C3=NN=NN3C4CC4)Cl

InChI

InChI=1S/C17H15ClN6O4S/c1-10-15(18)8-14(9-16(10)24(25)26)29(27,28)20-12-4-2-3-11(7-12)17-19-21-22-23(17)13-5-6-13/h2-4,7-9,13,20H,5-6H2,1H3