ethyl 2-[(1-methyl-4-pyrrolidin-1-ylsulfonyl-pyrrol-2-yl)carbonylamino]-4-phenyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[(1-methyl-4-pyrrolidin-1-ylsulfonyl-pyrrol-2-yl)carbonylamino]-4-phenyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[(1-methyl-4-pyrrolidin-1-ylsulfonyl-pyrrole-2-carbonyl)amino]-4-phenyl-thiazole-5-carboxylate CAS Name: 2-[[[1-methyl-4-(1-pyrrolidinylsulfonyl)-2-pyrrolyl]-oxomethyl]amino]-4-phenyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(1-methyl-4-pyrrolidin-1-ylsulfonylpyrrole-2-carbonyl)amino]-4-phenyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[(1-methyl-4-pyrrolidinosulfonyl-pyrrole-2-carbonyl)amino]-4-phenyl-thiazole-5-carboxylic acid ethyl ester Formula: C22H24N4O5S2 MolecularWeight: 488.57976

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)C2=CC(=CN2C)S(=O)(=O)N3CCCC3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)C2=CC(=CN2C)S(=O)(=O)N3CCCC3)C4=CC=CC=C4

InChI

InChI=1S/C22H24N4O5S2/c1-3-31-21(28)19-18(15-9-5-4-6-10-15)23-22(32-19)24-20(27)17-13-16(14-25(17)2)33(29,30)26-11-7-8-12-26/h4-6,9-10,13-14H,3,7-8,11-12H2,1-2H3,(H,23,24,27)