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

Systemtic Name: N-butyl-3,4,5-trimethoxy-N-[5-(2-methylphenyl)-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: N-butyl-3,4,5-trimethoxy-N-[5-(o-tolyl)-1,3,4-thiadiazol-2-yl]benzamide CAS Name: N-butyl-3,4,5-trimethoxy-N-[5-(2-methylphenyl)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: N-butyl-3,4,5-trimethoxy-N-[5-(2-methylphenyl)-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: N-butyl-3,4,5-trimethoxy-N-[5-(o-tolyl)-1,3,4-thiadiazol-2-yl]benzamide Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=NN=C(S1)C2=CC=CC=C2C)C(=O)C3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

CCCCN(C1=NN=C(S1)C2=CC=CC=C2C)C(=O)C3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C23H27N3O4S/c1-6-7-12-26(23-25-24-21(31-23)17-11-9-8-10-15(17)2)22(27)16-13-18(28-3)20(30-5)19(14-16)29-4/h8-11,13-14H,6-7,12H2,1-5H3