2-[4-(5-cyclopentylpentoxy)phenyl]-5-(4-hexylphenyl)-1,3,4-thiadiazole

Systemtic Name: 2-[4-(5-cyclopentylpentoxy)phenyl]-5-(4-hexylphenyl)-1,3,4-thiadiazole Openeye Name: 2-[4-(5-cyclopentylpentoxy)phenyl]-5-(4-hexylphenyl)-1,3,4-thiadiazole CAS Name: 2-[4-(5-cyclopentylpentoxy)phenyl]-5-(4-hexylphenyl)-1,3,4-thiadiazole IUPAC Name: 2-[4-(5-cyclopentylpentoxy)phenyl]-5-(4-hexylphenyl)-1,3,4-thiadiazole Traditional Name: 2-[4-(5-cyclopentylpentoxy)phenyl]-5-(4-hexylphenyl)-1,3,4-thiadiazole Formula: C30H40N2OS MolecularWeight: 476.7164

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C2=NN=C(S2)C3=CC=C(C=C3)OCCCCCC4CCCC4

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C2=NN=C(S2)C3=CC=C(C=C3)OCCCCCC4CCCC4

InChI

InChI=1S/C30H40N2OS/c1-2-3-4-6-12-25-15-17-26(18-16-25)29-31-32-30(34-29)27-19-21-28(22-20-27)33-23-10-5-7-11-24-13-8-9-14-24/h15-22,24H,2-14,23H2,1H3