4-methyl-2-[4-(pentanoylamino)phenyl]-1,3-thiazole-5-carboxylate

Systemtic Name: 4-methyl-2-[4-(pentanoylamino)phenyl]-1,3-thiazole-5-carboxylate Openeye Name: 4-methyl-2-[4-(pentanoylamino)phenyl]thiazole-5-carboxylate CAS Name: 4-methyl-2-[4-(1-oxopentylamino)phenyl]-5-thiazolecarboxylate IUPAC Name: 4-methyl-2-[4-(pentanoylamino)phenyl]-1,3-thiazole-5-carboxylate Traditional Name: 4-methyl-2-[4-(valerylamino)phenyl]thiazole-5-carboxylate Formula: C16H17N2O3S- MolecularWeight: 317.38278

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC=C(C=C1)C2=NC(=C(S2)C(=O)[O-])C

Isomeric SMILES

CCCCC(=O)NC1=CC=C(C=C1)C2=NC(=C(S2)C(=O)[O-])C

InChI

InChI=1S/C16H18N2O3S/c1-3-4-5-13(19)18-12-8-6-11(7-9-12)15-17-10(2)14(22-15)16(20)21/h6-9H,3-5H2,1-2H3,(H,18,19)(H,20,21)/p-1