2-(1-adamantylmethoxycarbonylamino)-3-[[5-(3-methoxy-3-oxidanylidene-propyl)thiophen-2-yl]carbonylamino]propanoic acid

Systemtic Name: 2-(1-adamantylmethoxycarbonylamino)-3-[[5-(3-methoxy-3-oxidanylidene-propyl)thiophen-2-yl]carbonylamino]propanoic acid Openeye Name: 2-(1-adamantylmethoxycarbonylamino)-3-[[5-(3-methoxy-3-oxo-propyl)thiophene-2-carbonyl]amino]propanoic acid CAS Name: 2-[[1-adamantylmethoxy(oxo)methyl]amino]-3-[[[5-(3-methoxy-3-oxopropyl)-2-thiophenyl]-oxomethyl]amino]propanoic acid IUPAC Name: 2-(1-adamantylmethoxycarbonylamino)-3-[[5-(3-methoxy-3-oxopropyl)thiophene-2-carbonyl]amino]propanoic acid Traditional Name: 2-(1-adamantylmethoxycarbonylamino)-3-[[5-(3-keto-3-methoxy-propyl)thiophene-2-carbonyl]amino]propionic acid Formula: C24H32N2O7S MolecularWeight: 492.58508

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CC=C(S1)C(=O)NCC(C(=O)O)NC(=O)OCC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

COC(=O)CCC1=CC=C(S1)C(=O)NCC(C(=O)O)NC(=O)OCC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C24H32N2O7S/c1-32-20(27)5-3-17-2-4-19(34-17)21(28)25-12-18(22(29)30)26-23(31)33-13-24-9-14-6-15(10-24)8-16(7-14)11-24/h2,4,14-16,18H,3,5-13H2,1H3,(H,25,28)(H,26,31)(H,29,30)