2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-N-(4-phenyl-1,3-thiazol-2-yl)butanamide

Systemtic Name: 2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-N-(4-phenyl-1,3-thiazol-2-yl)butanamide Openeye Name: 2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-N-(4-phenylthiazol-2-yl)butanamide CAS Name: 2-[(6-ethoxy-1,3-benzothiazol-2-yl)thio]-N-(4-phenyl-2-thiazolyl)butanamide IUPAC Name: 2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-N-(4-phenyl-1,3-thiazol-2-yl)butanamide Traditional Name: 2-[(6-ethoxy-1,3-benzothiazol-2-yl)thio]-N-(4-phenylthiazol-2-yl)butyramide Formula: C22H21N3O2S3 MolecularWeight: 455.61604

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NC(=CS1)C2=CC=CC=C2)SC3=NC4=C(S3)C=C(C=C4)OCC

Isomeric SMILES

CCC(C(=O)NC1=NC(=CS1)C2=CC=CC=C2)SC3=NC4=C(S3)C=C(C=C4)OCC

InChI

InChI=1S/C22H21N3O2S3/c1-3-18(29-22-24-16-11-10-15(27-4-2)12-19(16)30-22)20(26)25-21-23-17(13-28-21)14-8-6-5-7-9-14/h5-13,18H,3-4H2,1-2H3,(H,23,25,26)