methyl 5-(4-phenylbutanoylamino)-1,2,3-thiadiazole-4-carboxylate

Systemtic Name: methyl 5-(4-phenylbutanoylamino)-1,2,3-thiadiazole-4-carboxylate Openeye Name: methyl 5-(4-phenylbutanoylamino)thiadiazole-4-carboxylate CAS Name: 5-[(1-oxo-4-phenylbutyl)amino]-4-thiadiazolecarboxylic acid methyl ester IUPAC Name: methyl 5-(4-phenylbutanoylamino)thiadiazole-4-carboxylate Traditional Name: 5-(4-phenylbutanoylamino)thiadiazole-4-carboxylic acid methyl ester Formula: C14H15N3O3S MolecularWeight: 305.3522

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SN=N1)NC(=O)CCCC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=C(SN=N1)NC(=O)CCCC2=CC=CC=C2

InChI

InChI=1S/C14H15N3O3S/c1-20-14(19)12-13(21-17-16-12)15-11(18)9-5-8-10-6-3-2-4-7-10/h2-4,6-7H,5,8-9H2,1H3,(H,15,18)