N-[2-[(3-ethoxy-4-methoxy-phenyl)methylamino]-2-oxidanylidene-ethyl]-1,2-dimethyl-4-methylsulfonyl-6-oxidanylidene-piperazine-2-carboxamide

Systemtic Name: N-[2-[(3-ethoxy-4-methoxy-phenyl)methylamino]-2-oxidanylidene-ethyl]-1,2-dimethyl-4-methylsulfonyl-6-oxidanylidene-piperazine-2-carboxamide Openeye Name: N-[2-[(3-ethoxy-4-methoxy-phenyl)methylamino]-2-oxo-ethyl]-1,2-dimethyl-4-methylsulfonyl-6-oxo-piperazine-2-carboxamide CAS Name: N-[2-[(3-ethoxy-4-methoxyphenyl)methylamino]-2-oxoethyl]-1,2-dimethyl-4-methylsulfonyl-6-oxo-2-piperazinecarboxamide IUPAC Name: N-[2-[(3-ethoxy-4-methoxyphenyl)methylamino]-2-oxoethyl]-1,2-dimethyl-4-methylsulfonyl-6-oxopiperazine-2-carboxamide Traditional Name: N-[2-[(3-ethoxy-4-methoxy-benzyl)amino]-2-keto-ethyl]-6-keto-4-mesyl-1,2-dimethyl-piperazine-2-carboxamide Formula: C20H30N4O7S MolecularWeight: 470.5398

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)CNC(=O)CNC(=O)C2(CN(CC(=O)N2C)S(=O)(=O)C)C)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)CNC(=O)CNC(=O)C2(CN(CC(=O)N2C)S(=O)(=O)C)C)OC

InChI

InChI=1S/C20H30N4O7S/c1-6-31-16-9-14(7-8-15(16)30-4)10-21-17(25)11-22-19(27)20(2)13-24(32(5,28)29)12-18(26)23(20)3/h7-9H,6,10-13H2,1-5H3,(H,21,25)(H,22,27)