(2-phenyl-1,3-thiazol-4-yl)methyl 3-(1-adamantylcarbamoylamino)propanoate

Systemtic Name: (2-phenyl-1,3-thiazol-4-yl)methyl 3-(1-adamantylcarbamoylamino)propanoate Openeye Name: (2-phenylthiazol-4-yl)methyl 3-(1-adamantylcarbamoylamino)propanoate CAS Name: 3-[[(1-adamantylamino)-oxomethyl]amino]propanoic acid (2-phenyl-4-thiazolyl)methyl ester IUPAC Name: (2-phenyl-1,3-thiazol-4-yl)methyl 3-(1-adamantylcarbamoylamino)propanoate Traditional Name: 3-(1-adamantylcarbamoylamino)propionic acid (2-phenylthiazol-4-yl)methyl ester Formula: C24H29N3O3S MolecularWeight: 439.57036

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)NCCC(=O)OCC4=CSC(=N4)C5=CC=CC=C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)NCCC(=O)OCC4=CSC(=N4)C5=CC=CC=C5

InChI

InChI=1S/C24H29N3O3S/c28-21(30-14-20-15-31-22(26-20)19-4-2-1-3-5-19)6-7-25-23(29)27-24-11-16-8-17(12-24)10-18(9-16)13-24/h1-5,15-18H,6-14H2,(H2,25,27,29)