N'-(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)carbonyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbohydrazide

Systemtic Name: N'-(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)carbonyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbohydrazide Openeye Name: N'-(2-chloro-5-pyrrolidin-1-ylsulfonyl-benzoyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbohydrazide CAS Name: N'-[[2-chloro-5-(1-pyrrolidinylsulfonyl)phenyl]-oxomethyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbohydrazide IUPAC Name: N'-(2-chloro-5-pyrrolidin-1-ylsulfonylbenzoyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbohydrazide Traditional Name: N'-(2-chloro-5-pyrrolidinosulfonyl-benzoyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbohydrazide Formula: C21H24ClN3O4S2 MolecularWeight: 482.01596

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(CC1)SC(=C2)C(=O)NNC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCC4)Cl

Isomeric SMILES

C1CCC2=C(CC1)SC(=C2)C(=O)NNC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCC4)Cl

InChI

InChI=1S/C21H24ClN3O4S2/c22-17-9-8-15(31(28,29)25-10-4-5-11-25)13-16(17)20(26)23-24-21(27)19-12-14-6-2-1-3-7-18(14)30-19/h8-9,12-13H,1-7,10-11H2,(H,23,26)(H,24,27)