ethyl 2-[2-[(3-aminocarbonyl-4-azanyl-1,2-thiazol-5-yl)carbonyl-(thiophen-2-ylmethyl)amino]ethanoylamino]ethanoate

Systemtic Name: ethyl 2-[2-[(3-aminocarbonyl-4-azanyl-1,2-thiazol-5-yl)carbonyl-(thiophen-2-ylmethyl)amino]ethanoylamino]ethanoate Openeye Name: ethyl 2-[[2-[(4-amino-3-carbamoyl-isothiazole-5-carbonyl)-(2-thienylmethyl)amino]acetyl]amino]acetate CAS Name: 2-[[2-[[(4-amino-3-carbamoyl-5-isothiazolyl)-oxomethyl]-(thiophen-2-ylmethyl)amino]-1-oxoethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[2-[(4-amino-3-carbamoyl-1,2-thiazole-5-carbonyl)-(thiophen-2-ylmethyl)amino]acetyl]amino]acetate Traditional Name: 2-[[2-[(4-amino-3-carbamoyl-isothiazole-5-carbonyl)-(2-thenyl)amino]acetyl]amino]acetic acid ethyl ester Formula: C16H19N5O5S2 MolecularWeight: 425.48256

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)CN(CC1=CC=CS1)C(=O)C2=C(C(=NS2)C(=O)N)N

Isomeric SMILES

CCOC(=O)CNC(=O)CN(CC1=CC=CS1)C(=O)C2=C(C(=NS2)C(=O)N)N

InChI

InChI=1S/C16H19N5O5S2/c1-2-26-11(23)6-19-10(22)8-21(7-9-4-3-5-27-9)16(25)14-12(17)13(15(18)24)20-28-14/h3-5H,2,6-8,17H2,1H3,(H2,18,24)(H,19,22)