ethyl 4-[2-[methylsulfonyl-(4-morpholin-4-ylcarbonylphenyl)amino]ethanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[methylsulfonyl-(4-morpholin-4-ylcarbonylphenyl)amino]ethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[N-methylsulfonyl-4-(morpholine-4-carbonyl)anilino]acetyl]piperazine-1-carboxylate CAS Name: 4-[2-[N-methylsulfonyl-4-[4-morpholinyl(oxo)methyl]anilino]-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[N-methylsulfonyl-4-(morpholine-4-carbonyl)anilino]acetyl]piperazine-1-carboxylate Traditional Name: 4-[2-[N-mesyl-4-(morpholine-4-carbonyl)anilino]acetyl]piperazine-1-carboxylic acid ethyl ester Formula: C21H30N4O7S MolecularWeight: 482.5505

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CN(C2=CC=C(C=C2)C(=O)N3CCOCC3)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CN(C2=CC=C(C=C2)C(=O)N3CCOCC3)S(=O)(=O)C

InChI

InChI=1S/C21H30N4O7S/c1-3-32-21(28)24-10-8-22(9-11-24)19(26)16-25(33(2,29)30)18-6-4-17(5-7-18)20(27)23-12-14-31-15-13-23/h4-7H,3,8-16H2,1-2H3