ethyl 4-phenyl-2-[(1-thiophen-2-ylsulfonylpiperidin-4-yl)carbonylamino]-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-phenyl-2-[(1-thiophen-2-ylsulfonylpiperidin-4-yl)carbonylamino]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-phenyl-2-[[1-(2-thienylsulfonyl)piperidine-4-carbonyl]amino]thiazole-5-carboxylate CAS Name: 2-[[oxo-(1-thiophen-2-ylsulfonyl-4-piperidinyl)methyl]amino]-4-phenyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-phenyl-2-[(1-thiophen-2-ylsulfonylpiperidine-4-carbonyl)amino]-1,3-thiazole-5-carboxylate Traditional Name: 4-phenyl-2-[[1-(2-thienylsulfonyl)isonipecotoyl]amino]thiazole-5-carboxylic acid ethyl ester Formula: C22H23N3O5S3 MolecularWeight: 505.63012

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3)C4=CC=CC=C4

InChI

InChI=1S/C22H23N3O5S3/c1-2-30-21(27)19-18(15-7-4-3-5-8-15)23-22(32-19)24-20(26)16-10-12-25(13-11-16)33(28,29)17-9-6-14-31-17/h3-9,14,16H,2,10-13H2,1H3,(H,23,24,26)