ethyl 4-[[2-azanyl-3-(1,3-thiazol-4-yl)propanoyl]amino]-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 4-[[2-azanyl-3-(1,3-thiazol-4-yl)propanoyl]amino]-1H-pyrrole-2-carboxylate Openeye Name: ethyl 4-[(2-amino-3-thiazol-4-yl-propanoyl)amino]-1H-pyrrole-2-carboxylate CAS Name: 4-[[2-amino-1-oxo-3-(4-thiazolyl)propyl]amino]-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-amino-3-(1,3-thiazol-4-yl)propanoyl]amino]-1H-pyrrole-2-carboxylate Traditional Name: 4-[(2-amino-3-thiazol-4-yl-propanoyl)amino]-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C13H16N4O3S MolecularWeight: 308.35614

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CN1)NC(=O)C(CC2=CSC=N2)N

Isomeric SMILES

CCOC(=O)C1=CC(=CN1)NC(=O)C(CC2=CSC=N2)N

InChI

InChI=1S/C13H16N4O3S/c1-2-20-13(19)11-4-8(5-15-11)17-12(18)10(14)3-9-6-21-7-16-9/h4-7,10,15H,2-3,14H2,1H3,(H,17,18)