3-chloranyl-4-methyl-N-[[4-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]aniline

Systemtic Name: 3-chloranyl-4-methyl-N-[[4-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]aniline Openeye Name: N-[(5-benzylsulfanyl-4-methyl-1,2,4-triazol-3-yl)methyl]-3-chloro-4-methyl-aniline CAS Name: 3-chloro-4-methyl-N-[[4-methyl-5-(phenylmethylthio)-1,2,4-triazol-3-yl]methyl]aniline IUPAC Name: N-[(5-benzylsulfanyl-4-methyl-1,2,4-triazol-3-yl)methyl]-3-chloro-4-methylaniline Traditional Name: [5-(benzylthio)-4-methyl-1,2,4-triazol-3-yl]methyl-(3-chloro-4-methyl-phenyl)amine Formula: C18H19ClN4S MolecularWeight: 358.88826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NCC2=NN=C(N2C)SCC3=CC=CC=C3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NCC2=NN=C(N2C)SCC3=CC=CC=C3)Cl

InChI

InChI=1S/C18H19ClN4S/c1-13-8-9-15(10-16(13)19)20-11-17-21-22-18(23(17)2)24-12-14-6-4-3-5-7-14/h3-10,20H,11-12H2,1-2H3