2-chloranyl-N-[2-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)ethyl]-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-[2-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)ethyl]-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-[2-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)ethyl]-5-(1-piperidylsulfonyl)benzamide CAS Name: 2-chloro-N-[2-(1-ethyl-3,5-dimethyl-4-pyrazolyl)ethyl]-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: 2-chloro-N-[2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]-5-piperidin-1-ylsulfonylbenzamide Traditional Name: 2-chloro-N-[2-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)ethyl]-5-piperidinosulfonyl-benzamide Formula: C21H29ClN4O3S MolecularWeight: 452.99796

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)CCNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)Cl)C

Isomeric SMILES

CCN1C(=C(C(=N1)C)CCNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)Cl)C

InChI

InChI=1S/C21H29ClN4O3S/c1-4-26-16(3)18(15(2)24-26)10-11-23-21(27)19-14-17(8-9-20(19)22)30(28,29)25-12-6-5-7-13-25/h8-9,14H,4-7,10-13H2,1-3H3,(H,23,27)