4-[6-[4-(diethylamino)phenyl]-3-pentylsulfanyl-1,2,4-triazin-5-yl]-N,N-diethyl-aniline

Systemtic Name: 4-[6-[4-(diethylamino)phenyl]-3-pentylsulfanyl-1,2,4-triazin-5-yl]-N,N-diethyl-aniline Openeye Name: 4-[6-[4-(diethylamino)phenyl]-3-pentylsulfanyl-1,2,4-triazin-5-yl]-N,N-diethyl-aniline CAS Name: 4-[6-[4-(diethylamino)phenyl]-3-(pentylthio)-1,2,4-triazin-5-yl]-N,N-diethylaniline IUPAC Name: 4-[6-[4-(diethylamino)phenyl]-3-pentylsulfanyl-1,2,4-triazin-5-yl]-N,N-diethylaniline Traditional Name: [4-[3-(amylthio)-5-[4-(diethylamino)phenyl]-1,2,4-triazin-6-yl]phenyl]-diethyl-amine Formula: C28H39N5S MolecularWeight: 477.70776

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC1=NC(=C(N=N1)C2=CC=C(C=C2)N(CC)CC)C3=CC=C(C=C3)N(CC)CC

Isomeric SMILES

CCCCCSC1=NC(=C(N=N1)C2=CC=C(C=C2)N(CC)CC)C3=CC=C(C=C3)N(CC)CC

InChI

InChI=1S/C28H39N5S/c1-6-11-12-21-34-28-29-26(22-13-17-24(18-14-22)32(7-2)8-3)27(30-31-28)23-15-19-25(20-16-23)33(9-4)10-5/h13-20H,6-12,21H2,1-5H3