N-butyl-3-chloranyl-N-[5-(3,4,5-trimethoxyphenyl)-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: N-butyl-3-chloranyl-N-[5-(3,4,5-trimethoxyphenyl)-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: N-butyl-3-chloro-N-[5-(3,4,5-trimethoxyphenyl)-1,3,4-thiadiazol-2-yl]benzamide CAS Name: N-butyl-3-chloro-N-[5-(3,4,5-trimethoxyphenyl)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: N-butyl-3-chloro-N-[5-(3,4,5-trimethoxyphenyl)-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: N-butyl-3-chloro-N-[5-(3,4,5-trimethoxyphenyl)-1,3,4-thiadiazol-2-yl]benzamide Formula: C22H24ClN3O4S MolecularWeight: 461.96166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=NN=C(S1)C2=CC(=C(C(=C2)OC)OC)OC)C(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

CCCCN(C1=NN=C(S1)C2=CC(=C(C(=C2)OC)OC)OC)C(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C22H24ClN3O4S/c1-5-6-10-26(21(27)14-8-7-9-16(23)11-14)22-25-24-20(31-22)15-12-17(28-2)19(30-4)18(13-15)29-3/h7-9,11-13H,5-6,10H2,1-4H3