methyl 2-[[2-[2-(2-azanyl-1,3-thiazol-4-yl)ethanoylamino]-3-phenyl-propanoyl]amino]ethanoate

Systemtic Name: methyl 2-[[2-[2-(2-azanyl-1,3-thiazol-4-yl)ethanoylamino]-3-phenyl-propanoyl]amino]ethanoate Openeye Name: methyl 2-[[2-[[2-(2-aminothiazol-4-yl)acetyl]amino]-3-phenyl-propanoyl]amino]acetate CAS Name: 2-[[2-[[2-(2-amino-4-thiazolyl)-1-oxoethyl]amino]-1-oxo-3-phenylpropyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[2-[[2-(2-amino-1,3-thiazol-4-yl)acetyl]amino]-3-phenylpropanoyl]amino]acetate Traditional Name: 2-[[2-[[2-(2-aminothiazol-4-yl)acetyl]amino]-3-phenyl-propanoyl]amino]acetic acid methyl ester Formula: C17H20N4O4S MolecularWeight: 376.4301

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)C(CC1=CC=CC=C1)NC(=O)CC2=CSC(=N2)N

Isomeric SMILES

COC(=O)CNC(=O)C(CC1=CC=CC=C1)NC(=O)CC2=CSC(=N2)N

InChI

InChI=1S/C17H20N4O4S/c1-25-15(23)9-19-16(24)13(7-11-5-3-2-4-6-11)21-14(22)8-12-10-26-17(18)20-12/h2-6,10,13H,7-9H2,1H3,(H2,18,20)(H,19,24)(H,21,22)