N-butyl-N-[5-(4-methoxy-3,5-dimethyl-phenyl)-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: N-butyl-N-[5-(4-methoxy-3,5-dimethyl-phenyl)-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: N-butyl-N-[5-(4-methoxy-3,5-dimethyl-phenyl)-1,3,4-thiadiazol-2-yl]benzamide CAS Name: N-butyl-N-[5-(4-methoxy-3,5-dimethylphenyl)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: N-butyl-N-[5-(4-methoxy-3,5-dimethylphenyl)-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: N-butyl-N-[5-(4-methoxy-3,5-dimethyl-phenyl)-1,3,4-thiadiazol-2-yl]benzamide Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N3O2S/c1-5-6-12-25(21(26)17-10-8-7-9-11-17)22-24-23-20(28-22)18-13-15(2)19(27-4)16(3)14-18/h7-11,13-14H,5-6,12H2,1-4H3