N'-[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbonyl]-1-pyridin-3-ylsulfonyl-piperidine-4-carbohydrazide

Systemtic Name: N'-[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbonyl]-1-pyridin-3-ylsulfonyl-piperidine-4-carbohydrazide Openeye Name: N'-(5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)-1-(3-pyridylsulfonyl)piperidine-4-carbohydrazide CAS Name: N'-[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-oxomethyl]-1-(3-pyridinylsulfonyl)-4-piperidinecarbohydrazide IUPAC Name: N'-(5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbonyl)-1-pyridin-3-ylsulfonylpiperidine-4-carbohydrazide Traditional Name: N'-(5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)-1-(3-pyridylsulfonyl)isonipecotohydrazide Formula: C21H26N4O4S2 MolecularWeight: 462.58554

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)NNC(=O)C3CCN(CC3)S(=O)(=O)C4=CN=CC=C4

Isomeric SMILES

CC1CCC2=C(C1)C=C(S2)C(=O)NNC(=O)C3CCN(CC3)S(=O)(=O)C4=CN=CC=C4

InChI

InChI=1S/C21H26N4O4S2/c1-14-4-5-18-16(11-14)12-19(30-18)21(27)24-23-20(26)15-6-9-25(10-7-15)31(28,29)17-3-2-8-22-13-17/h2-3,8,12-15H,4-7,9-11H2,1H3,(H,23,26)(H,24,27)