2-(4-octoxyphenyl)-5-(3-propoxyphenyl)-3H-1,2,3-thiadiazole

Systemtic Name: 2-(4-octoxyphenyl)-5-(3-propoxyphenyl)-3H-1,2,3-thiadiazole Openeye Name: 2-(4-octoxyphenyl)-5-(3-propoxyphenyl)-3H-thiadiazole CAS Name: 2-(4-octoxyphenyl)-5-(3-propoxyphenyl)-3H-thiadiazole IUPAC Name: 2-(4-octoxyphenyl)-5-(3-propoxyphenyl)-3H-thiadiazole Traditional Name: 2-(4-octoxyphenyl)-5-(3-propoxyphenyl)-3H-thiadiazole Formula: C25H34N2O2S MolecularWeight: 426.61466

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)N2NC=C(S2)C3=CC(=CC=C3)OCCC

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)N2NC=C(S2)C3=CC(=CC=C3)OCCC

InChI

InChI=1S/C25H34N2O2S/c1-3-5-6-7-8-9-18-29-23-15-13-22(14-16-23)27-26-20-25(30-27)21-11-10-12-24(19-21)28-17-4-2/h10-16,19-20,26H,3-9,17-18H2,1-2H3