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

Systemtic Name: N-[[1-(4-methylphenyl)-1,2,3,4-tetrazol-5-yl]methyl]-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[[1-(p-tolyl)tetrazol-5-yl]methyl]-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[[1-(4-methylphenyl)-5-tetrazolyl]methyl]-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[[1-(4-methylphenyl)tetrazol-5-yl]methyl]-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[[1-(p-tolyl)tetrazol-5-yl]methyl]-4-pyrrolidinosulfonyl-benzamide Formula: C20H22N6O3S MolecularWeight: 426.49208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=N2)CNC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=N2)CNC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C20H22N6O3S/c1-15-4-8-17(9-5-15)26-19(22-23-24-26)14-21-20(27)16-6-10-18(11-7-16)30(28,29)25-12-2-3-13-25/h4-11H,2-3,12-14H2,1H3,(H,21,27)