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

Systemtic Name: cyanomethyl 2-(3-methylbutylamino)-1,3-thiazole-4-carboxylate Openeye Name: cyanomethyl 2-(isopentylamino)thiazole-4-carboxylate CAS Name: 2-(3-methylbutylamino)-4-thiazolecarboxylic acid cyanomethyl ester IUPAC Name: cyanomethyl 2-(3-methylbutylamino)-1,3-thiazole-4-carboxylate Traditional Name: 2-(isoamylamino)thiazole-4-carboxylic acid cyanomethyl ester Formula: C11H15N3O2S MolecularWeight: 253.3207

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=NC(=CS1)C(=O)OCC#N

Isomeric SMILES

CC(C)CCNC1=NC(=CS1)C(=O)OCC#N

InChI

InChI=1S/C11H15N3O2S/c1-8(2)3-5-13-11-14-9(7-17-11)10(15)16-6-4-12/h7-8H,3,5-6H2,1-2H3,(H,13,14)