(5E)-3-ethyl-5-(3-methyl-1,3-benzothiazol-2-ylidene)-2-octadecylimino-1,3-thiazolidin-4-one

Systemtic Name: (5E)-3-ethyl-5-(3-methyl-1,3-benzothiazol-2-ylidene)-2-octadecylimino-1,3-thiazolidin-4-one Openeye Name: (5E)-3-ethyl-5-(3-methyl-1,3-benzothiazol-2-ylidene)-2-octadecylimino-thiazolidin-4-one CAS Name: (5E)-3-ethyl-5-(3-methyl-1,3-benzothiazol-2-ylidene)-2-octadecylimino-4-thiazolidinone IUPAC Name: (5E)-3-ethyl-5-(3-methyl-1,3-benzothiazol-2-ylidene)-2-octadecylimino-1,3-thiazolidin-4-one Traditional Name: (5E)-3-ethyl-5-(3-methyl-1,3-benzothiazol-2-ylidene)-2-stearylimino-thiazolidin-4-one Formula: C31H49N3OS2 MolecularWeight: 543.87026

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN=C1N(C(=O)C(=C2N(C3=CC=CC=C3S2)C)S1)CC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN=C1N(C(=O)/C(=C\2/N(C3=CC=CC=C3S2)C)/S1)CC

InChI

InChI=1S/C31H49N3OS2/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-25-32-31-34(5-2)29(35)28(37-31)30-33(3)26-23-20-21-24-27(26)36-30/h20-21,23-24H,4-19,22,25H2,1-3H3/b30-28+,32-31?