(2R)-6-methyl-N'-(4-pyrrolidin-1-ylsulfonylphenyl)carbonyl-2,3-dihydro-1-benzothiophene-2-carbohydrazide

Systemtic Name: (2R)-6-methyl-N'-(4-pyrrolidin-1-ylsulfonylphenyl)carbonyl-2,3-dihydro-1-benzothiophene-2-carbohydrazide Openeye Name: (2R)-6-methyl-N'-(4-pyrrolidin-1-ylsulfonylbenzoyl)-2,3-dihydrobenzothiophene-2-carbohydrazide CAS Name: (2R)-6-methyl-N'-[oxo-[4-(1-pyrrolidinylsulfonyl)phenyl]methyl]-2,3-dihydro-1-benzothiophene-2-carbohydrazide IUPAC Name: (2R)-6-methyl-N'-(4-pyrrolidin-1-ylsulfonylbenzoyl)-2,3-dihydro-1-benzothiophene-2-carbohydrazide Traditional Name: (2R)-6-methyl-N'-(4-pyrrolidinosulfonylbenzoyl)-2,3-dihydrobenzothiophene-2-carbohydrazide Formula: C21H23N3O4S2 MolecularWeight: 445.55502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(CC(S2)C(=O)NNC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4)C=C1

Isomeric SMILES

CC1=CC2=C(C[C@@H](S2)C(=O)NNC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4)C=C1

InChI

InChI=1S/C21H23N3O4S2/c1-14-4-5-16-13-19(29-18(16)12-14)21(26)23-22-20(25)15-6-8-17(9-7-15)30(27,28)24-10-2-3-11-24/h4-9,12,19H,2-3,10-11,13H2,1H3,(H,22,25)(H,23,26)/t19-/m1/s1