2-[4-[(4-methyl-1,4-diazepan-1-yl)sulfonyl]pyrazol-1-yl]ethanoic acid

Systemtic Name: 2-[4-[(4-methyl-1,4-diazepan-1-yl)sulfonyl]pyrazol-1-yl]ethanoic acid Openeye Name: 2-[4-[(4-methyl-1,4-diazepan-1-yl)sulfonyl]pyrazol-1-yl]acetic acid CAS Name: 2-[4-[(4-methyl-1,4-diazepan-1-yl)sulfonyl]-1-pyrazolyl]acetic acid IUPAC Name: 2-[4-[(4-methyl-1,4-diazepan-1-yl)sulfonyl]pyrazol-1-yl]acetic acid Traditional Name: 2-[4-[(4-methyl-1,4-diazepan-1-yl)sulfonyl]pyrazol-1-yl]acetic acid Formula: C11H18N4O4S MolecularWeight: 302.35002

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(CC1)S(=O)(=O)C2=CN(N=C2)CC(=O)O

Isomeric SMILES

CN1CCCN(CC1)S(=O)(=O)C2=CN(N=C2)CC(=O)O

InChI

InChI=1S/C11H18N4O4S/c1-13-3-2-4-15(6-5-13)20(18,19)10-7-12-14(8-10)9-11(16)17/h7-8H,2-6,9H2,1H3,(H,16,17)