N-[2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-N-methyl-thiophene-2-sulfonamide

Systemtic Name: N-[2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-N-methyl-thiophene-2-sulfonamide Openeye Name: N-[2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-2-oxo-ethyl]-N-methyl-thiophene-2-sulfonamide CAS Name: N-[2-[4-(4-tert-butylphenyl)sulfonyl-1-piperazinyl]-2-oxoethyl]-N-methyl-2-thiophenesulfonamide IUPAC Name: N-[2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-2-oxoethyl]-N-methylthiophene-2-sulfonamide Traditional Name: N-[2-[4-(4-tert-butylphenyl)sulfonylpiperazino]-2-keto-ethyl]-N-methyl-thiophene-2-sulfonamide Formula: C21H29N3O5S3 MolecularWeight: 499.66706

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CN(C)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CN(C)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C21H29N3O5S3/c1-21(2,3)17-7-9-18(10-8-17)31(26,27)24-13-11-23(12-14-24)19(25)16-22(4)32(28,29)20-6-5-15-30-20/h5-10,15H,11-14,16H2,1-4H3