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

Systemtic Name: ethyl 2-[2-[(3-aminocarbonyl-4-azanyl-1,2-thiazol-5-yl)carbonyl-(4-ethylphenyl)amino]ethanoylamino]ethanoate Openeye Name: ethyl 2-[[2-(N-(4-amino-3-carbamoyl-isothiazole-5-carbonyl)-4-ethyl-anilino)acetyl]amino]acetate CAS Name: 2-[[2-(N-[(4-amino-3-carbamoyl-5-isothiazolyl)-oxomethyl]-4-ethylanilino)-1-oxoethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[2-(N-(4-amino-3-carbamoyl-1,2-thiazole-5-carbonyl)-4-ethylanilino)acetyl]amino]acetate Traditional Name: 2-[[2-(N-(4-amino-3-carbamoyl-isothiazole-5-carbonyl)-4-ethyl-anilino)acetyl]amino]acetic acid ethyl ester Formula: C19H23N5O5S MolecularWeight: 433.48142

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N(CC(=O)NCC(=O)OCC)C(=O)C2=C(C(=NS2)C(=O)N)N

Isomeric SMILES

CCC1=CC=C(C=C1)N(CC(=O)NCC(=O)OCC)C(=O)C2=C(C(=NS2)C(=O)N)N

InChI

InChI=1S/C19H23N5O5S/c1-3-11-5-7-12(8-6-11)24(10-13(25)22-9-14(26)29-4-2)19(28)17-15(20)16(18(21)27)23-30-17/h5-8H,3-4,9-10,20H2,1-2H3,(H2,21,27)(H,22,25)