ethyl 3-[2-(1,3-benzothiazol-6-ylcarbonylimino)-1,3-benzothiazol-3-yl]propanoate

Systemtic Name: ethyl 3-[2-(1,3-benzothiazol-6-ylcarbonylimino)-1,3-benzothiazol-3-yl]propanoate Openeye Name: ethyl 3-[2-(1,3-benzothiazole-6-carbonylimino)-1,3-benzothiazol-3-yl]propanoate CAS Name: 3-[2-[1,3-benzothiazol-6-yl(oxo)methyl]imino-1,3-benzothiazol-3-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[2-(1,3-benzothiazole-6-carbonylimino)-1,3-benzothiazol-3-yl]propanoate Traditional Name: 3-[2-(1,3-benzothiazole-6-carbonylimino)-1,3-benzothiazol-3-yl]propionic acid ethyl ester Formula: C20H17N3O3S2 MolecularWeight: 411.49728

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN1C2=CC=CC=C2SC1=NC(=O)C3=CC4=C(C=C3)N=CS4

Isomeric SMILES

CCOC(=O)CCN1C2=CC=CC=C2SC1=NC(=O)C3=CC4=C(C=C3)N=CS4

InChI

InChI=1S/C20H17N3O3S2/c1-2-26-18(24)9-10-23-15-5-3-4-6-16(15)28-20(23)22-19(25)13-7-8-14-17(11-13)27-12-21-14/h3-8,11-12H,2,9-10H2,1H3