N'-[(E)-3-[4-(azepan-1-ylsulfonyl)phenyl]prop-2-enoyl]furan-2-carbohydrazide

Systemtic Name: N'-[(E)-3-[4-(azepan-1-ylsulfonyl)phenyl]prop-2-enoyl]furan-2-carbohydrazide Openeye Name: N'-[(E)-3-[4-(azepan-1-ylsulfonyl)phenyl]prop-2-enoyl]furan-2-carbohydrazide CAS Name: N'-[(E)-3-[4-(1-azepanylsulfonyl)phenyl]-1-oxoprop-2-enyl]-2-furancarbohydrazide IUPAC Name: N'-[(E)-3-[4-(azepan-1-ylsulfonyl)phenyl]prop-2-enoyl]furan-2-carbohydrazide Traditional Name: N'-[(E)-3-[4-(azepan-1-ylsulfonyl)phenyl]acryloyl]-2-furohydrazide Formula: C20H23N3O5S MolecularWeight: 417.47872

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C=CC(=O)NNC(=O)C3=CC=CO3

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)/C=C/C(=O)NNC(=O)C3=CC=CO3

InChI

InChI=1S/C20H23N3O5S/c24-19(21-22-20(25)18-6-5-15-28-18)12-9-16-7-10-17(11-8-16)29(26,27)23-13-3-1-2-4-14-23/h5-12,15H,1-4,13-14H2,(H,21,24)(H,22,25)/b12-9+