(2S)-4-[2-[(4-methoxyphenyl)sulfonylamino]-1,4,5,6-tetrahydropyrimidin-6-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid

Systemtic Name: (2S)-4-[2-[(4-methoxyphenyl)sulfonylamino]-1,4,5,6-tetrahydropyrimidin-6-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid Openeye Name: (2S)-2-(tert-butoxycarbonylamino)-4-[2-[(4-methoxyphenyl)sulfonylamino]-1,4,5,6-tetrahydropyrimidin-6-yl]butanoic acid CAS Name: (2S)-4-[2-[(4-methoxyphenyl)sulfonylamino]-1,4,5,6-tetrahydropyrimidin-6-yl]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butanoic acid IUPAC Name: (2S)-4-[2-[(4-methoxyphenyl)sulfonylamino]-1,4,5,6-tetrahydropyrimidin-6-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-4-[2-[(4-methoxyphenyl)sulfonylamino]-1,4,5,6-tetrahydropyrimidin-6-yl]butyric acid Formula: C20H30N4O7S MolecularWeight: 470.5398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCC1CCN=C(N1)NS(=O)(=O)C2=CC=C(C=C2)OC)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CCC1CCN=C(N1)NS(=O)(=O)C2=CC=C(C=C2)OC)C(=O)O

InChI

InChI=1S/C20H30N4O7S/c1-20(2,3)31-19(27)23-16(17(25)26)10-5-13-11-12-21-18(22-13)24-32(28,29)15-8-6-14(30-4)7-9-15/h6-9,13,16H,5,10-12H2,1-4H3,(H,23,27)(H,25,26)(H2,21,22,24)/t13?,16-/m0/s1