(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 2-[(4-cyanophenyl)sulfonylamino]ethanoate

Systemtic Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 2-[(4-cyanophenyl)sulfonylamino]ethanoate Openeye Name: [2-(3-thienyl)thiazol-4-yl]methyl 2-[(4-cyanophenyl)sulfonylamino]acetate CAS Name: 2-[(4-cyanophenyl)sulfonylamino]acetic acid [2-(3-thiophenyl)-4-thiazolyl]methyl ester IUPAC Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 2-[(4-cyanophenyl)sulfonylamino]acetate Traditional Name: 2-[(4-cyanophenyl)sulfonylamino]acetic acid [2-(3-thienyl)thiazol-4-yl]methyl ester Formula: C17H13N3O4S3 MolecularWeight: 419.49782

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)S(=O)(=O)NCC(=O)OCC2=CSC(=N2)C3=CSC=C3

Isomeric SMILES

C1=CC(=CC=C1C#N)S(=O)(=O)NCC(=O)OCC2=CSC(=N2)C3=CSC=C3

InChI

InChI=1S/C17H13N3O4S3/c18-7-12-1-3-15(4-2-12)27(22,23)19-8-16(21)24-9-14-11-26-17(20-14)13-5-6-25-10-13/h1-6,10-11,19H,8-9H2