(4-aminocarbonylphenyl)methyl 2-(3-methylbutylamino)-1,3-thiazole-4-carboxylate

Systemtic Name: (4-aminocarbonylphenyl)methyl 2-(3-methylbutylamino)-1,3-thiazole-4-carboxylate Openeye Name: (4-carbamoylphenyl)methyl 2-(isopentylamino)thiazole-4-carboxylate CAS Name: 2-(3-methylbutylamino)-4-thiazolecarboxylic acid (4-carbamoylphenyl)methyl ester IUPAC Name: (4-carbamoylphenyl)methyl 2-(3-methylbutylamino)-1,3-thiazole-4-carboxylate Traditional Name: 2-(isoamylamino)thiazole-4-carboxylic acid (4-carbamoylbenzyl) ester Formula: C17H21N3O3S MolecularWeight: 347.43194

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=NC(=CS1)C(=O)OCC2=CC=C(C=C2)C(=O)N

Isomeric SMILES

CC(C)CCNC1=NC(=CS1)C(=O)OCC2=CC=C(C=C2)C(=O)N

InChI

InChI=1S/C17H21N3O3S/c1-11(2)7-8-19-17-20-14(10-24-17)16(22)23-9-12-3-5-13(6-4-12)15(18)21/h3-6,10-11H,7-9H2,1-2H3,(H2,18,21)(H,19,20)