3-[2-[(5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbonyl]hydrazinyl]-3-oxidanylidene-N-phenyl-propane-1-sulfonamide

Systemtic Name: 3-[2-[(5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbonyl]hydrazinyl]-3-oxidanylidene-N-phenyl-propane-1-sulfonamide Openeye Name: 3-[2-(5-tert-butyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)hydrazino]-3-oxo-N-phenyl-propane-1-sulfonamide CAS Name: 3-[[(5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-oxomethyl]hydrazo]-3-oxo-N-phenyl-1-propanesulfonamide IUPAC Name: 3-[2-(5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbonyl)hydrazinyl]-3-oxo-N-phenylpropane-1-sulfonamide Traditional Name: 3-[N'-(5-tert-butyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)hydrazino]-3-keto-N-phenyl-propane-1-sulfonamide Formula: C22H29N3O4S2 MolecularWeight: 463.61336

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)C=C(S2)C(=O)NNC(=O)CCS(=O)(=O)NC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1CCC2=C(C1)C=C(S2)C(=O)NNC(=O)CCS(=O)(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H29N3O4S2/c1-22(2,3)16-9-10-18-15(13-16)14-19(30-18)21(27)24-23-20(26)11-12-31(28,29)25-17-7-5-4-6-8-17/h4-8,14,16,25H,9-13H2,1-3H3,(H,23,26)(H,24,27)