(2-phenyl-1,3-thiazol-4-yl)methyl 2-(5-piperidin-1-ylsulfonylthiophen-2-yl)ethanoate

Systemtic Name: (2-phenyl-1,3-thiazol-4-yl)methyl 2-(5-piperidin-1-ylsulfonylthiophen-2-yl)ethanoate Openeye Name: (2-phenylthiazol-4-yl)methyl 2-[5-(1-piperidylsulfonyl)-2-thienyl]acetate CAS Name: 2-[5-(1-piperidinylsulfonyl)-2-thiophenyl]acetic acid (2-phenyl-4-thiazolyl)methyl ester IUPAC Name: (2-phenyl-1,3-thiazol-4-yl)methyl 2-(5-piperidin-1-ylsulfonylthiophen-2-yl)acetate Traditional Name: 2-(5-piperidinosulfonyl-2-thienyl)acetic acid (2-phenylthiazol-4-yl)methyl ester Formula: C21H22N2O4S3 MolecularWeight: 462.60538

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(S2)CC(=O)OCC3=CSC(=N3)C4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(S2)CC(=O)OCC3=CSC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C21H22N2O4S3/c24-19(27-14-17-15-28-21(22-17)16-7-3-1-4-8-16)13-18-9-10-20(29-18)30(25,26)23-11-5-2-6-12-23/h1,3-4,7-10,15H,2,5-6,11-14H2