2-[2-(4-ethylphenoxy)ethylsulfanyl]-1-prop-2-ynyl-benzimidazole

Systemtic Name: 2-[2-(4-ethylphenoxy)ethylsulfanyl]-1-prop-2-ynyl-benzimidazole Openeye Name: 2-[2-(4-ethylphenoxy)ethylsulfanyl]-1-prop-2-ynyl-benzimidazole CAS Name: 2-[2-(4-ethylphenoxy)ethylthio]-1-prop-2-ynylbenzimidazole IUPAC Name: 2-[2-(4-ethylphenoxy)ethylsulfanyl]-1-prop-2-ynylbenzimidazole Traditional Name: 2-[2-(4-ethylphenoxy)ethylthio]-1-propargyl-benzimidazole Formula: C20H20N2OS MolecularWeight: 336.4506

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCCSC2=NC3=CC=CC=C3N2CC#C

Isomeric SMILES

CCC1=CC=C(C=C1)OCCSC2=NC3=CC=CC=C3N2CC#C

InChI

InChI=1S/C20H20N2OS/c1-3-13-22-19-8-6-5-7-18(19)21-20(22)24-15-14-23-17-11-9-16(4-2)10-12-17/h1,5-12H,4,13-15H2,2H3