N'-[3-[4-(azepan-1-ylsulfonyl)phenyl]propanoyl]-2-methyl-furan-3-carbohydrazide

Systemtic Name: N'-[3-[4-(azepan-1-ylsulfonyl)phenyl]propanoyl]-2-methyl-furan-3-carbohydrazide Openeye Name: N'-[3-[4-(azepan-1-ylsulfonyl)phenyl]propanoyl]-2-methyl-furan-3-carbohydrazide CAS Name: N'-[3-[4-(1-azepanylsulfonyl)phenyl]-1-oxopropyl]-2-methyl-3-furancarbohydrazide IUPAC Name: N'-[3-[4-(azepan-1-ylsulfonyl)phenyl]propanoyl]-2-methylfuran-3-carbohydrazide Traditional Name: N'-[3-[4-(azepan-1-ylsulfonyl)phenyl]propanoyl]-2-methyl-3-furohydrazide Formula: C21H27N3O5S MolecularWeight: 433.52118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C(=O)NNC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C=CO1)C(=O)NNC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C21H27N3O5S/c1-16-19(12-15-29-16)21(26)23-22-20(25)11-8-17-6-9-18(10-7-17)30(27,28)24-13-4-2-3-5-14-24/h6-7,9-10,12,15H,2-5,8,11,13-14H2,1H3,(H,22,25)(H,23,26)