N-[5,6-dimethoxy-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-4-phenylsulfanyl-butanamide

Systemtic Name: N-[5,6-dimethoxy-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-4-phenylsulfanyl-butanamide Openeye Name: N-[5,6-dimethoxy-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-4-phenylsulfanyl-butanamide CAS Name: N-[5,6-dimethoxy-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-4-(phenylthio)butanamide IUPAC Name: N-[5,6-dimethoxy-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-4-phenylsulfanylbutanamide Traditional Name: N-[5,6-dimethoxy-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-4-(phenylthio)butyramide Formula: C22H26N2O4S2 MolecularWeight: 446.58284

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C2=CC(=C(C=C2SC1=NC(=O)CCCSC3=CC=CC=C3)OC)OC

Isomeric SMILES

COCCN1C2=CC(=C(C=C2SC1=NC(=O)CCCSC3=CC=CC=C3)OC)OC

InChI

InChI=1S/C22H26N2O4S2/c1-26-12-11-24-17-14-18(27-2)19(28-3)15-20(17)30-22(24)23-21(25)10-7-13-29-16-8-5-4-6-9-16/h4-6,8-9,14-15H,7,10-13H2,1-3H3