2-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]ethanamide

Systemtic Name: 2-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]ethanamide Openeye Name: 2-(1-cyclopropyltetrazol-5-yl)sulfanyl-N-[2-(4-methylsulfonyl-2-nitro-anilino)ethyl]acetamide CAS Name: 2-[(1-cyclopropyl-5-tetrazolyl)thio]-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]acetamide IUPAC Name: 2-(1-cyclopropyltetrazol-5-yl)sulfanyl-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]acetamide Traditional Name: 2-[(1-cyclopropyltetrazol-5-yl)thio]-N-[2-(4-mesyl-2-nitro-anilino)ethyl]acetamide Formula: C15H19N7O5S2 MolecularWeight: 441.48526

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)NCCNC(=O)CSC2=NN=NN2C3CC3)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)NCCNC(=O)CSC2=NN=NN2C3CC3)[N+](=O)[O-]

InChI

InChI=1S/C15H19N7O5S2/c1-29(26,27)11-4-5-12(13(8-11)22(24)25)16-6-7-17-14(23)9-28-15-18-19-20-21(15)10-2-3-10/h4-5,8,10,16H,2-3,6-7,9H2,1H3,(H,17,23)