4-butoxy-N-[5-(4-heptoxyphenyl)-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 4-butoxy-N-[5-(4-heptoxyphenyl)-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 4-butoxy-N-[5-(4-heptoxyphenyl)-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 4-butoxy-N-[5-(4-heptoxyphenyl)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 4-butoxy-N-[5-(4-heptoxyphenyl)-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 4-butoxy-N-[5-(4-heptoxyphenyl)-1,3,4-thiadiazol-2-yl]benzamide Formula: C26H33N3O3S MolecularWeight: 467.62352

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C2=NN=C(S2)NC(=O)C3=CC=C(C=C3)OCCCC

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C2=NN=C(S2)NC(=O)C3=CC=C(C=C3)OCCCC

InChI

InChI=1S/C26H33N3O3S/c1-3-5-7-8-9-19-32-23-16-12-21(13-17-23)25-28-29-26(33-25)27-24(30)20-10-14-22(15-11-20)31-18-6-4-2/h10-17H,3-9,18-19H2,1-2H3,(H,27,29,30)