3-(azepan-1-ylsulfonyl)-N-(2,5-dimethylpyrazol-3-yl)-4-methoxy-benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-(2,5-dimethylpyrazol-3-yl)-4-methoxy-benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-(2,5-dimethylpyrazol-3-yl)-4-methoxy-benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-(2,5-dimethyl-3-pyrazolyl)-4-methoxybenzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-(2,5-dimethylpyrazol-3-yl)-4-methoxybenzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-(2,5-dimethylpyrazol-3-yl)-4-methoxy-benzamide Formula: C19H26N4O4S MolecularWeight: 406.49914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCCCC3)C

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCCCC3)C

InChI

InChI=1S/C19H26N4O4S/c1-14-12-18(22(2)21-14)20-19(24)15-8-9-16(27-3)17(13-15)28(25,26)23-10-6-4-5-7-11-23/h8-9,12-13H,4-7,10-11H2,1-3H3,(H,20,24)