2-[ethyl-[4-[(4-hexadecylsulfanylphenyl)iminomethyl]phenyl]amino]ethanenitrile

Systemtic Name: 2-[ethyl-[4-[(4-hexadecylsulfanylphenyl)iminomethyl]phenyl]amino]ethanenitrile Openeye Name: 2-[N-ethyl-4-[(4-hexadecylsulfanylphenyl)iminomethyl]anilino]acetonitrile CAS Name: 2-[N-ethyl-4-[[4-(hexadecylthio)phenyl]iminomethyl]anilino]acetonitrile IUPAC Name: 2-[N-ethyl-4-[(4-hexadecylsulfanylphenyl)iminomethyl]anilino]acetonitrile Traditional Name: 2-[4-[[4-(cetylthio)phenyl]iminomethyl]-N-ethyl-anilino]acetonitrile Formula: C33H49N3S MolecularWeight: 519.82726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCSC1=CC=C(C=C1)N=CC2=CC=C(C=C2)N(CC)CC#N

Isomeric SMILES

CCCCCCCCCCCCCCCCSC1=CC=C(C=C1)N=CC2=CC=C(C=C2)N(CC)CC#N

InChI

InChI=1S/C33H49N3S/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-28-37-33-24-20-31(21-25-33)35-29-30-18-22-32(23-19-30)36(4-2)27-26-34/h18-25,29H,3-17,27-28H2,1-2H3