3-[4-(4-hydroxyphenyl)carbonylpiperazin-1-yl]carbonyl-N-prop-2-ynyl-benzenesulfonamide

Systemtic Name: 3-[4-(4-hydroxyphenyl)carbonylpiperazin-1-yl]carbonyl-N-prop-2-ynyl-benzenesulfonamide Openeye Name: 3-[4-(4-hydroxybenzoyl)piperazine-1-carbonyl]-N-prop-2-ynyl-benzenesulfonamide CAS Name: 3-[[4-[(4-hydroxyphenyl)-oxomethyl]-1-piperazinyl]-oxomethyl]-N-prop-2-ynylbenzenesulfonamide IUPAC Name: 3-[4-(4-hydroxybenzoyl)piperazine-1-carbonyl]-N-prop-2-ynylbenzenesulfonamide Traditional Name: 3-[4-(4-hydroxybenzoyl)piperazine-1-carbonyl]-N-propargyl-benzenesulfonamide Formula: C21H21N3O5S MolecularWeight: 427.47354

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNS(=O)(=O)C1=CC=CC(=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)O

Isomeric SMILES

C#CCNS(=O)(=O)C1=CC=CC(=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)O

InChI

InChI=1S/C21H21N3O5S/c1-2-10-22-30(28,29)19-5-3-4-17(15-19)21(27)24-13-11-23(12-14-24)20(26)16-6-8-18(25)9-7-16/h1,3-9,15,22,25H,10-14H2