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

Systemtic Name: N-[5,6-dimethoxy-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-3-phenylsulfanyl-propanamide Openeye Name: N-[5,6-dimethoxy-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-3-phenylsulfanyl-propanamide CAS Name: N-[5,6-dimethoxy-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-3-(phenylthio)propanamide IUPAC Name: N-[5,6-dimethoxy-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-3-phenylsulfanylpropanamide Traditional Name: N-[5,6-dimethoxy-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-3-(phenylthio)propionamide Formula: C21H24N2O4S2 MolecularWeight: 432.55626

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C2=CC(=C(C=C2SC1=NC(=O)CCSC3=CC=CC=C3)OC)OC

Isomeric SMILES

COCCN1C2=CC(=C(C=C2SC1=NC(=O)CCSC3=CC=CC=C3)OC)OC

InChI

InChI=1S/C21H24N2O4S2/c1-25-11-10-23-16-13-17(26-2)18(27-3)14-19(16)29-21(23)22-20(24)9-12-28-15-7-5-4-6-8-15/h4-8,13-14H,9-12H2,1-3H3