methyl 4-[2-[[3-(phenylsulfonylmethyl)furan-2-yl]carbonylamino]-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxylate

Systemtic Name: methyl 4-[2-[[3-(phenylsulfonylmethyl)furan-2-yl]carbonylamino]-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxylate Openeye Name: methyl 4-[2-[[3-(benzenesulfonylmethyl)furan-2-carbonyl]amino]thiazol-4-yl]-1H-pyrrole-2-carboxylate CAS Name: 4-[2-[[[3-(benzenesulfonylmethyl)-2-furanyl]-oxomethyl]amino]-4-thiazolyl]-1H-pyrrole-2-carboxylic acid methyl ester IUPAC Name: methyl 4-[2-[[3-(benzenesulfonylmethyl)furan-2-carbonyl]amino]-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxylate Traditional Name: 4-[2-[[3-(besylmethyl)-2-furoyl]amino]thiazol-4-yl]-1H-pyrrole-2-carboxylic acid methyl ester Formula: C21H17N3O6S2 MolecularWeight: 471.50618

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CN1)C2=CSC(=N2)NC(=O)C3=C(C=CO3)CS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC(=CN1)C2=CSC(=N2)NC(=O)C3=C(C=CO3)CS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H17N3O6S2/c1-29-20(26)16-9-14(10-22-16)17-11-31-21(23-17)24-19(25)18-13(7-8-30-18)12-32(27,28)15-5-3-2-4-6-15/h2-11,22H,12H2,1H3,(H,23,24,25)