(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 2-[(4-butoxyphenyl)carbonylamino]ethanoate

Systemtic Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 2-[(4-butoxyphenyl)carbonylamino]ethanoate Openeye Name: [2-(3-thienyl)thiazol-4-yl]methyl 2-[(4-butoxybenzoyl)amino]acetate CAS Name: 2-[[(4-butoxyphenyl)-oxomethyl]amino]acetic acid [2-(3-thiophenyl)-4-thiazolyl]methyl ester IUPAC Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 2-[(4-butoxybenzoyl)amino]acetate Traditional Name: 2-[(4-butoxybenzoyl)amino]acetic acid [2-(3-thienyl)thiazol-4-yl]methyl ester Formula: C21H22N2O4S2 MolecularWeight: 430.54038

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NCC(=O)OCC2=CSC(=N2)C3=CSC=C3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NCC(=O)OCC2=CSC(=N2)C3=CSC=C3

InChI

InChI=1S/C21H22N2O4S2/c1-2-3-9-26-18-6-4-15(5-7-18)20(25)22-11-19(24)27-12-17-14-29-21(23-17)16-8-10-28-13-16/h4-8,10,13-14H,2-3,9,11-12H2,1H3,(H,22,25)