2-[(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-[(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-(1-cyclohexyltetrazol-5-yl)sulfanyl-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)acetamide CAS Name: 2-[(1-cyclohexyl-5-tetrazolyl)thio]-N-[4-ethoxy-3-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(1-cyclohexyltetrazol-5-yl)sulfanyl-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[(1-cyclohexyltetrazol-5-yl)thio]-N-(4-ethoxy-3-pyrrolidinosulfonyl-phenyl)acetamide Formula: C21H30N6O4S2 MolecularWeight: 494.6307

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)CSC2=NN=NN2C3CCCCC3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)CSC2=NN=NN2C3CCCCC3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C21H30N6O4S2/c1-2-31-18-11-10-16(14-19(18)33(29,30)26-12-6-7-13-26)22-20(28)15-32-21-23-24-25-27(21)17-8-4-3-5-9-17/h10-11,14,17H,2-9,12-13,15H2,1H3,(H,22,28)