3-(azepan-1-ylsulfonyl)-N-(2-cyclopentylpyrazol-3-yl)-4-methoxy-benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-(2-cyclopentylpyrazol-3-yl)-4-methoxy-benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-(2-cyclopentylpyrazol-3-yl)-4-methoxy-benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-(2-cyclopentyl-3-pyrazolyl)-4-methoxybenzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-(2-cyclopentylpyrazol-3-yl)-4-methoxybenzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-(2-cyclopentylpyrazol-3-yl)-4-methoxy-benzamide Formula: C22H30N4O4S MolecularWeight: 446.563

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC=NN2C3CCCC3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC=NN2C3CCCC3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C22H30N4O4S/c1-30-19-11-10-17(16-20(19)31(28,29)25-14-6-2-3-7-15-25)22(27)24-21-12-13-23-26(21)18-8-4-5-9-18/h10-13,16,18H,2-9,14-15H2,1H3,(H,24,27)