ethyl 4-methyl-2-[3-(3-oxidanylidene-1,4-benzoxazin-4-yl)propanoyl-pentyl-amino]-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-methyl-2-[3-(3-oxidanylidene-1,4-benzoxazin-4-yl)propanoyl-pentyl-amino]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-methyl-2-[3-(3-oxo-1,4-benzoxazin-4-yl)propanoyl-pentyl-amino]thiazole-5-carboxylate CAS Name: 4-methyl-2-[[1-oxo-3-(3-oxo-1,4-benzoxazin-4-yl)propyl]-pentylamino]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[3-(3-oxo-1,4-benzoxazin-4-yl)propanoyl-pentylamino]-1,3-thiazole-5-carboxylate Traditional Name: 2-[amyl-[3-(3-keto-1,4-benzoxazin-4-yl)propanoyl]amino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C23H29N3O5S MolecularWeight: 459.55846

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(C1=NC(=C(S1)C(=O)OCC)C)C(=O)CCN2C(=O)COC3=CC=CC=C32

Isomeric SMILES

CCCCCN(C1=NC(=C(S1)C(=O)OCC)C)C(=O)CCN2C(=O)COC3=CC=CC=C32

InChI

InChI=1S/C23H29N3O5S/c1-4-6-9-13-26(23-24-16(3)21(32-23)22(29)30-5-2)19(27)12-14-25-17-10-7-8-11-18(17)31-15-20(25)28/h7-8,10-11H,4-6,9,12-15H2,1-3H3