diethyl 2-acetamido-2-[4-(1,3-dithian-2-ylidene)-2-[(2-methylpropan-2-yl)oxycarbonylamino]cyclopentyl]propanedioate

Systemtic Name: diethyl 2-acetamido-2-[4-(1,3-dithian-2-ylidene)-2-[(2-methylpropan-2-yl)oxycarbonylamino]cyclopentyl]propanedioate Openeye Name: diethyl 2-acetamido-2-[2-(tert-butoxycarbonylamino)-4-(1,3-dithian-2-ylidene)cyclopentyl]propanedioate CAS Name: 2-acetamido-2-[4-(1,3-dithian-2-ylidene)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]cyclopentyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-acetamido-2-[4-(1,3-dithian-2-ylidene)-2-[(2-methylpropan-2-yl)oxycarbonylamino]cyclopentyl]propanedioate Traditional Name: 2-acetamido-2-[2-(tert-butoxycarbonylamino)-4-(1,3-dithian-2-ylidene)cyclopentyl]malonic acid diethyl ester Formula: C23H36N2O7S2 MolecularWeight: 516.67114

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1CC(=C2SCCCS2)CC1NC(=O)OC(C)(C)C)(C(=O)OCC)NC(=O)C

Isomeric SMILES

CCOC(=O)C(C1CC(=C2SCCCS2)CC1NC(=O)OC(C)(C)C)(C(=O)OCC)NC(=O)C

InChI

InChI=1S/C23H36N2O7S2/c1-7-30-19(27)23(25-14(3)26,20(28)31-8-2)16-12-15(18-33-10-9-11-34-18)13-17(16)24-21(29)32-22(4,5)6/h16-17H,7-13H2,1-6H3,(H,24,29)(H,25,26)