but-2-ynoxybenzene; 3-[2-(diethylamino)propylsulfanyl]-3-methyl-N-(methylamino)-N-oxidanyl-4-sulfonyl-butanamide

Systemtic Name: but-2-ynoxybenzene; 3-[2-(diethylamino)propylsulfanyl]-3-methyl-N-(methylamino)-N-oxidanyl-4-sulfonyl-butanamide Openeye Name: but-2-ynoxybenzene; 3-[2-(diethylamino)propylsulfanyl]-N-hydroxy-3-methyl-N-(methylamino)-4-sulfonyl-butanamide CAS Name: but-2-ynoxybenzene; 3-[2-(diethylamino)propylthio]-N-hydroxy-3-methyl-N-(methylamino)-4-sulfonylbutanamide IUPAC Name: but-2-ynoxybenzene; 3-[2-(diethylamino)propylsulfanyl]-N-hydroxy-3-methyl-N-(methylamino)-4-sulfonylbutanamide Traditional Name: but-2-ynoxybenzene; 3-[2-(diethylamino)propylthio]-N-hydroxy-3-methyl-N-(methylamino)-4-sulfonyl-butyramide Formula: C23H37N3O5S2 MolecularWeight: 499.68698

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(C)CSC(C)(CC(=O)N(NC)O)C=S(=O)=O.CC#CCOC1=CC=CC=C1

Isomeric SMILES

CCN(CC)C(C)CSC(C)(CC(=O)N(NC)O)C=S(=O)=O.CC#CCOC1=CC=CC=C1

InChI

InChI=1S/C13H27N3O4S2.C10H10O/c1-6-15(7-2)11(3)9-21-13(4,10-22(19)20)8-12(17)16(18)14-5;1-2-3-9-11-10-7-5-4-6-8-10/h10-11,14,18H,6-9H2,1-5H3;4-8H,9H2,1H3