ethyl 2-[(4-ethanoylpiperazin-1-yl)sulfonylcarbamoylamino]-6,6-dimethyl-5,7-dihydro-4H-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-[(4-ethanoylpiperazin-1-yl)sulfonylcarbamoylamino]-6,6-dimethyl-5,7-dihydro-4H-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[(4-acetylpiperazin-1-yl)sulfonylcarbamoylamino]-6,6-dimethyl-5,7-dihydro-4H-benzothiophene-3-carboxylate CAS Name: 2-[[[(4-acetyl-1-piperazinyl)sulfonylamino]-oxomethyl]amino]-6,6-dimethyl-5,7-dihydro-4H-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-acetylpiperazin-1-yl)sulfonylcarbamoylamino]-6,6-dimethyl-5,7-dihydro-4H-1-benzothiophene-3-carboxylate Traditional Name: 2-[(4-acetylpiperazino)sulfonylcarbamoylamino]-6,6-dimethyl-5,7-dihydro-4H-benzothiophene-3-carboxylic acid ethyl ester Formula: C20H30N4O6S2 MolecularWeight: 486.6054

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCC(C2)(C)C)NC(=O)NS(=O)(=O)N3CCN(CC3)C(=O)C

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCC(C2)(C)C)NC(=O)NS(=O)(=O)N3CCN(CC3)C(=O)C

InChI

InChI=1S/C20H30N4O6S2/c1-5-30-18(26)16-14-6-7-20(3,4)12-15(14)31-17(16)21-19(27)22-32(28,29)24-10-8-23(9-11-24)13(2)25/h5-12H2,1-4H3,(H2,21,22,27)