4-[(2-azanyl-4-phenyl-1,3-thiazol-5-yl)carbonylamino]butanoate

Systemtic Name: 4-[(2-azanyl-4-phenyl-1,3-thiazol-5-yl)carbonylamino]butanoate Openeye Name: 4-[(2-amino-4-phenyl-thiazole-5-carbonyl)amino]butanoate CAS Name: 4-[[(2-amino-4-phenyl-5-thiazolyl)-oxomethyl]amino]butanoate IUPAC Name: 4-[(2-amino-4-phenyl-1,3-thiazole-5-carbonyl)amino]butanoate Traditional Name: 4-[(2-amino-4-phenyl-thiazole-5-carbonyl)amino]butyrate Formula: C14H14N3O3S- MolecularWeight: 304.34426

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(SC(=N2)N)C(=O)NCCCC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=C(SC(=N2)N)C(=O)NCCCC(=O)[O-]

InChI

InChI=1S/C14H15N3O3S/c15-14-17-11(9-5-2-1-3-6-9)12(21-14)13(20)16-8-4-7-10(18)19/h1-3,5-6H,4,7-8H2,(H2,15,17)(H,16,20)(H,18,19)/p-1