N-[[1-(4-ethoxyphenyl)-1,2,3,4-tetrazol-5-yl]methyl]-4-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[[1-(4-ethoxyphenyl)-1,2,3,4-tetrazol-5-yl]methyl]-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[[1-(4-ethoxyphenyl)tetrazol-5-yl]methyl]-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[[1-(4-ethoxyphenyl)-5-tetrazolyl]methyl]-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[[1-(4-ethoxyphenyl)tetrazol-5-yl]methyl]-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[(1-p-phenetyltetrazol-5-yl)methyl]-4-pyrrolidinosulfonyl-benzamide Formula: C21H24N6O4S MolecularWeight: 456.51806

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=NN=N2)CNC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=NN=N2)CNC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C21H24N6O4S/c1-2-31-18-9-7-17(8-10-18)27-20(23-24-25-27)15-22-21(28)16-5-11-19(12-6-16)32(29,30)26-13-3-4-14-26/h5-12H,2-4,13-15H2,1H3,(H,22,28)