5-[(E)-4-(4-chlorophenyl)sulfanyl-4-thiophen-2-yl-but-2-enyl]-6-methyl-1,2,4-triazin-3-amine

Systemtic Name: 5-[(E)-4-(4-chlorophenyl)sulfanyl-4-thiophen-2-yl-but-2-enyl]-6-methyl-1,2,4-triazin-3-amine Openeye Name: 5-[(E)-4-(4-chlorophenyl)sulfanyl-4-(2-thienyl)but-2-enyl]-6-methyl-1,2,4-triazin-3-amine CAS Name: 5-[(E)-4-[(4-chlorophenyl)thio]-4-thiophen-2-ylbut-2-enyl]-6-methyl-1,2,4-triazin-3-amine IUPAC Name: 5-[(E)-4-(4-chlorophenyl)sulfanyl-4-thiophen-2-ylbut-2-enyl]-6-methyl-1,2,4-triazin-3-amine Traditional Name: [5-[(E)-4-[(4-chlorophenyl)thio]-4-(2-thienyl)but-2-enyl]-6-methyl-1,2,4-triazin-3-yl]amine Formula: C18H17ClN4S2 MolecularWeight: 388.93738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=N1)N)CC=CC(C2=CC=CS2)SC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(N=C(N=N1)N)C/C=C/C(C2=CC=CS2)SC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H17ClN4S2/c1-12-15(21-18(20)23-22-12)4-2-5-17(16-6-3-11-24-16)25-14-9-7-13(19)8-10-14/h2-3,5-11,17H,4H2,1H3,(H2,20,21,23)/b5-2+