2-[3-heptyl-4-(2-octoxyphenyl)phenyl]-1,3-thiazole

Systemtic Name: 2-[3-heptyl-4-(2-octoxyphenyl)phenyl]-1,3-thiazole Openeye Name: 2-[3-heptyl-4-(2-octoxyphenyl)phenyl]thiazole CAS Name: 2-[3-heptyl-4-(2-octoxyphenyl)phenyl]thiazole IUPAC Name: 2-[3-heptyl-4-(2-octoxyphenyl)phenyl]-1,3-thiazole Traditional Name: 2-[3-heptyl-4-(2-octoxyphenyl)phenyl]thiazole Formula: C30H41NOS MolecularWeight: 463.71764

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=CC=C1C2=C(C=C(C=C2)C3=NC=CS3)CCCCCCC

Isomeric SMILES

CCCCCCCCOC1=CC=CC=C1C2=C(C=C(C=C2)C3=NC=CS3)CCCCCCC

InChI

InChI=1S/C30H41NOS/c1-3-5-7-9-11-15-22-32-29-18-14-13-17-28(29)27-20-19-26(30-31-21-23-33-30)24-25(27)16-12-10-8-6-4-2/h13-14,17-21,23-24H,3-12,15-16,22H2,1-2H3