[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-(1,3,5-trimethylpyrazol-4-yl)methanone

Systemtic Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-(1,3,5-trimethylpyrazol-4-yl)methanone Openeye Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-(1,3,5-trimethylpyrazol-4-yl)methanone CAS Name: [4-(1-azepanylsulfonyl)-1-piperazinyl]-(1,3,5-trimethyl-4-pyrazolyl)methanone IUPAC Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-(1,3,5-trimethylpyrazol-4-yl)methanone Traditional Name: [4-(azepan-1-ylsulfonyl)piperazino]-(1,3,5-trimethylpyrazol-4-yl)methanone Formula: C17H29N5O3S MolecularWeight: 383.50886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)C(=O)N2CCN(CC2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C(=NN1C)C)C(=O)N2CCN(CC2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C17H29N5O3S/c1-14-16(15(2)19(3)18-14)17(23)20-10-12-22(13-11-20)26(24,25)21-8-6-4-5-7-9-21/h4-13H2,1-3H3