N-[2-(4-dimethylaminophenyl)-2-thiophen-2-ylsulfonyl-ethyl]-2-(4-ethylpiperazin-1-yl)-2-oxidanylidene-ethanamide

Systemtic Name: N-[2-(4-dimethylaminophenyl)-2-thiophen-2-ylsulfonyl-ethyl]-2-(4-ethylpiperazin-1-yl)-2-oxidanylidene-ethanamide Openeye Name: N-[2-(4-dimethylaminophenyl)-2-(2-thienylsulfonyl)ethyl]-2-(4-ethylpiperazin-1-yl)-2-oxo-acetamide CAS Name: N-[2-(4-dimethylaminophenyl)-2-thiophen-2-ylsulfonylethyl]-2-(4-ethyl-1-piperazinyl)-2-oxoacetamide IUPAC Name: N-[2-(4-dimethylaminophenyl)-2-thiophen-2-ylsulfonylethyl]-2-(4-ethylpiperazin-1-yl)-2-oxoacetamide Traditional Name: N-[2-(4-dimethylaminophenyl)-2-(2-thienylsulfonyl)ethyl]-2-(4-ethylpiperazino)-2-keto-acetamide Formula: C22H30N4O4S2 MolecularWeight: 478.628

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)C(=O)NCC(C2=CC=C(C=C2)N(C)C)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CCN1CCN(CC1)C(=O)C(=O)NCC(C2=CC=C(C=C2)N(C)C)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C22H30N4O4S2/c1-4-25-11-13-26(14-12-25)22(28)21(27)23-16-19(32(29,30)20-6-5-15-31-20)17-7-9-18(10-8-17)24(2)3/h5-10,15,19H,4,11-14,16H2,1-3H3,(H,23,27)