methyl 2-[2-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]ethanoylimino]-3-prop-2-ynyl-1,3-benzothiazole-6-carboxylate

Systemtic Name: methyl 2-[2-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]ethanoylimino]-3-prop-2-ynyl-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 2-[2-(2,5-dioxopyrrolidin-1-yl)acetyl]imino-3-prop-2-ynyl-1,3-benzothiazole-6-carboxylate CAS Name: 2-[2-(2,5-dioxo-1-pyrrolidinyl)-1-oxoethyl]imino-3-prop-2-ynyl-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 2-[2-(2,5-dioxopyrrolidin-1-yl)acetyl]imino-3-prop-2-ynyl-1,3-benzothiazole-6-carboxylate Traditional Name: 3-propargyl-2-(2-succinimidoacetyl)imino-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C18H15N3O5S MolecularWeight: 385.3938

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)N(C(=NC(=O)CN3C(=O)CCC3=O)S2)CC#C

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)N(C(=NC(=O)CN3C(=O)CCC3=O)S2)CC#C

InChI

InChI=1S/C18H15N3O5S/c1-3-8-20-12-5-4-11(17(25)26-2)9-13(12)27-18(20)19-14(22)10-21-15(23)6-7-16(21)24/h1,4-5,9H,6-8,10H2,2H3