methyl 3-[[2-[(2-acetamido-4-methyl-1,3-thiazol-5-yl)sulfonylamino]-3-methoxy-3-oxidanylidene-propyl]sulfanylmethyl]-4-oxidanylidene-4-pyridin-3-yl-butanoate

Systemtic Name: methyl 3-[[2-[(2-acetamido-4-methyl-1,3-thiazol-5-yl)sulfonylamino]-3-methoxy-3-oxidanylidene-propyl]sulfanylmethyl]-4-oxidanylidene-4-pyridin-3-yl-butanoate Openeye Name: methyl 3-[[2-[(2-acetamido-4-methyl-thiazol-5-yl)sulfonylamino]-3-methoxy-3-oxo-propyl]sulfanylmethyl]-4-oxo-4-(3-pyridyl)butanoate CAS Name: 3-[[[2-[(2-acetamido-4-methyl-5-thiazolyl)sulfonylamino]-3-methoxy-3-oxopropyl]thio]methyl]-4-oxo-4-(3-pyridinyl)butanoic acid methyl ester IUPAC Name: methyl 3-[[2-[(2-acetamido-4-methyl-1,3-thiazol-5-yl)sulfonylamino]-3-methoxy-3-oxopropyl]sulfanylmethyl]-4-oxo-4-pyridin-3-ylbutanoate Traditional Name: 3-[[[2-[(2-acetamido-4-methyl-thiazol-5-yl)sulfonylamino]-3-keto-3-methoxy-propyl]thio]methyl]-4-keto-4-(3-pyridyl)butyric acid methyl ester Formula: C21H26N4O8S3 MolecularWeight: 558.64814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C)S(=O)(=O)NC(CSCC(CC(=O)OC)C(=O)C2=CN=CC=C2)C(=O)OC

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C)S(=O)(=O)NC(CSCC(CC(=O)OC)C(=O)C2=CN=CC=C2)C(=O)OC

InChI

InChI=1S/C21H26N4O8S3/c1-12-20(35-21(23-12)24-13(2)26)36(30,31)25-16(19(29)33-4)11-34-10-15(8-17(27)32-3)18(28)14-6-5-7-22-9-14/h5-7,9,15-16,25H,8,10-11H2,1-4H3,(H,23,24,26)