phenacyl 2-(3-methylbutylamino)-1,3-thiazole-4-carboxylate

Systemtic Name: phenacyl 2-(3-methylbutylamino)-1,3-thiazole-4-carboxylate Openeye Name: phenacyl 2-(isopentylamino)thiazole-4-carboxylate CAS Name: 2-(3-methylbutylamino)-4-thiazolecarboxylic acid phenacyl ester IUPAC Name: phenacyl 2-(3-methylbutylamino)-1,3-thiazole-4-carboxylate Traditional Name: 2-(isoamylamino)thiazole-4-carboxylic acid phenacyl ester Formula: C17H20N2O3S MolecularWeight: 332.4173

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=NC(=CS1)C(=O)OCC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)CCNC1=NC(=CS1)C(=O)OCC(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H20N2O3S/c1-12(2)8-9-18-17-19-14(11-23-17)16(21)22-10-15(20)13-6-4-3-5-7-13/h3-7,11-12H,8-10H2,1-2H3,(H,18,19)