N'-[(3-methyl-1-benzofuran-2-yl)carbonyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carbohydrazide

Systemtic Name: N'-[(3-methyl-1-benzofuran-2-yl)carbonyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carbohydrazide Openeye Name: N'-(3-methylbenzofuran-2-carbonyl)-1-(2-thienylsulfonyl)piperidine-4-carbohydrazide CAS Name: N'-[(3-methyl-2-benzofuranyl)-oxomethyl]-1-thiophen-2-ylsulfonyl-4-piperidinecarbohydrazide IUPAC Name: N'-(3-methyl-1-benzofuran-2-carbonyl)-1-thiophen-2-ylsulfonylpiperidine-4-carbohydrazide Traditional Name: N'-(3-methylbenzofuran-2-carbonyl)-1-(2-thienylsulfonyl)isonipecotohydrazide Formula: C20H21N3O5S2 MolecularWeight: 447.52784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=CC=CC=C12)C(=O)NNC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

CC1=C(OC2=CC=CC=C12)C(=O)NNC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C20H21N3O5S2/c1-13-15-5-2-3-6-16(15)28-18(13)20(25)22-21-19(24)14-8-10-23(11-9-14)30(26,27)17-7-4-12-29-17/h2-7,12,14H,8-11H2,1H3,(H,21,24)(H,22,25)