N-[4-(azepan-1-ylsulfonyl)phenyl]-5-[(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)methyl]furan-2-carboxamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-5-[(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)methyl]furan-2-carboxamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-5-[(4-chloro-3,5-dimethyl-pyrazol-1-yl)methyl]furan-2-carboxamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-5-[(4-chloro-3,5-dimethyl-1-pyrazolyl)methyl]-2-furancarboxamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-5-[(4-chloro-3,5-dimethylpyrazol-1-yl)methyl]furan-2-carboxamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-5-[(4-chloro-3,5-dimethyl-pyrazol-1-yl)methyl]-2-furamide Formula: C23H27ClN4O4S MolecularWeight: 491.00288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(O2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCCCC4)C)Cl

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(O2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCCCC4)C)Cl

InChI

InChI=1S/C23H27ClN4O4S/c1-16-22(24)17(2)28(26-16)15-19-9-12-21(32-19)23(29)25-18-7-10-20(11-8-18)33(30,31)27-13-5-3-4-6-14-27/h7-12H,3-6,13-15H2,1-2H3,(H,25,29)