4-[[(3-chlorophenyl)amino]methyl]-6-(3-methoxypropylsulfanyl)-1,3,5-triazin-2-amine

Systemtic Name: 4-[[(3-chlorophenyl)amino]methyl]-6-(3-methoxypropylsulfanyl)-1,3,5-triazin-2-amine Openeye Name: 4-[(3-chloroanilino)methyl]-6-(3-methoxypropylsulfanyl)-1,3,5-triazin-2-amine CAS Name: 4-[(3-chloroanilino)methyl]-6-(3-methoxypropylthio)-1,3,5-triazin-2-amine IUPAC Name: 4-[(3-chloroanilino)methyl]-6-(3-methoxypropylsulfanyl)-1,3,5-triazin-2-amine Traditional Name: [4-amino-6-(3-methoxypropylthio)-s-triazin-2-yl]methyl-(3-chlorophenyl)amine Formula: C14H18ClN5OS MolecularWeight: 339.84362

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Descriptors Computed from Structure

Canonical SMILES:

COCCCSC1=NC(=NC(=N1)N)CNC2=CC(=CC=C2)Cl

Isomeric SMILES

COCCCSC1=NC(=NC(=N1)N)CNC2=CC(=CC=C2)Cl

InChI

InChI=1S/C14H18ClN5OS/c1-21-6-3-7-22-14-19-12(18-13(16)20-14)9-17-11-5-2-4-10(15)8-11/h2,4-5,8,17H,3,6-7,9H2,1H3,(H2,16,18,19,20)