ethyl 2-[6-acetamido-2-[2-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]ethanoylimino]-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[6-acetamido-2-[2-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]ethanoylimino]-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[6-acetamido-2-[2-(2,5-dioxopyrrolidin-1-yl)acetyl]imino-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[6-acetamido-2-[2-(2,5-dioxo-1-pyrrolidinyl)-1-oxoethyl]imino-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[6-acetamido-2-[2-(2,5-dioxopyrrolidin-1-yl)acetyl]imino-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[6-acetamido-2-(2-succinimidoacetyl)imino-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C19H20N4O6S MolecularWeight: 432.4503

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2)NC(=O)C)SC1=NC(=O)CN3C(=O)CCC3=O

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(C=C2)NC(=O)C)SC1=NC(=O)CN3C(=O)CCC3=O

InChI

InChI=1S/C19H20N4O6S/c1-3-29-18(28)10-22-13-5-4-12(20-11(2)24)8-14(13)30-19(22)21-15(25)9-23-16(26)6-7-17(23)27/h4-5,8H,3,6-7,9-10H2,1-2H3,(H,20,24)