ethyl 4-methyl-2-[3-[(3-methylphenyl)carbonylamino]propanoyl-pentyl-amino]-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-methyl-2-[3-[(3-methylphenyl)carbonylamino]propanoyl-pentyl-amino]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-methyl-2-[3-[(3-methylbenzoyl)amino]propanoyl-pentyl-amino]thiazole-5-carboxylate CAS Name: 4-methyl-2-[[3-[[(3-methylphenyl)-oxomethyl]amino]-1-oxopropyl]-pentylamino]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[3-[(3-methylbenzoyl)amino]propanoyl-pentylamino]-1,3-thiazole-5-carboxylate Traditional Name: 2-[amyl-[3-(m-toluoylamino)propanoyl]amino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C23H31N3O4S MolecularWeight: 445.57494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(C1=NC(=C(S1)C(=O)OCC)C)C(=O)CCNC(=O)C2=CC(=CC=C2)C

Isomeric SMILES

CCCCCN(C1=NC(=C(S1)C(=O)OCC)C)C(=O)CCNC(=O)C2=CC(=CC=C2)C

InChI

InChI=1S/C23H31N3O4S/c1-5-7-8-14-26(23-25-17(4)20(31-23)22(29)30-6-2)19(27)12-13-24-21(28)18-11-9-10-16(3)15-18/h9-11,15H,5-8,12-14H2,1-4H3,(H,24,28)