N-(furan-2-ylmethyl)-N'-[2-(2-methoxyethoxymethylsulfanyl)-1,3-benzothiazol-6-yl]pentanediamide

Systemtic Name: N-(furan-2-ylmethyl)-N'-[2-(2-methoxyethoxymethylsulfanyl)-1,3-benzothiazol-6-yl]pentanediamide Openeye Name: N-(2-furylmethyl)-N'-[2-(2-methoxyethoxymethylsulfanyl)-1,3-benzothiazol-6-yl]pentanediamide CAS Name: N-(2-furanylmethyl)-N'-[2-(2-methoxyethoxymethylthio)-1,3-benzothiazol-6-yl]pentanediamide IUPAC Name: N-(furan-2-ylmethyl)-N'-[2-(2-methoxyethoxymethylsulfanyl)-1,3-benzothiazol-6-yl]pentanediamide Traditional Name: N-(2-furfuryl)-N'-[2-(2-methoxyethoxymethylthio)-1,3-benzothiazol-6-yl]glutaramide Formula: C21H25N3O5S2 MolecularWeight: 463.5703

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCOCSC1=NC2=C(S1)C=C(C=C2)NC(=O)CCCC(=O)NCC3=CC=CO3

Isomeric SMILES

COCCOCSC1=NC2=C(S1)C=C(C=C2)NC(=O)CCCC(=O)NCC3=CC=CO3

InChI

InChI=1S/C21H25N3O5S2/c1-27-10-11-28-14-30-21-24-17-8-7-15(12-18(17)31-21)23-20(26)6-2-5-19(25)22-13-16-4-3-9-29-16/h3-4,7-9,12H,2,5-6,10-11,13-14H2,1H3,(H,22,25)(H,23,26)