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

Systemtic Name: 4-[[(3-chlorophenyl)amino]methyl]-6-(cyclopentylmethylsulfanyl)-1,3,5-triazin-2-amine Openeye Name: 4-[(3-chloroanilino)methyl]-6-(cyclopentylmethylsulfanyl)-1,3,5-triazin-2-amine CAS Name: 4-[(3-chloroanilino)methyl]-6-(cyclopentylmethylthio)-1,3,5-triazin-2-amine IUPAC Name: 4-[(3-chloroanilino)methyl]-6-(cyclopentylmethylsulfanyl)-1,3,5-triazin-2-amine Traditional Name: [4-amino-6-(cyclopentylmethylthio)-s-triazin-2-yl]methyl-(3-chlorophenyl)amine Formula: C16H20ClN5S MolecularWeight: 349.8815

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CSC2=NC(=NC(=N2)N)CNC3=CC(=CC=C3)Cl

Isomeric SMILES

C1CCC(C1)CSC2=NC(=NC(=N2)N)CNC3=CC(=CC=C3)Cl

InChI

InChI=1S/C16H20ClN5S/c17-12-6-3-7-13(8-12)19-9-14-20-15(18)22-16(21-14)23-10-11-4-1-2-5-11/h3,6-8,11,19H,1-2,4-5,9-10H2,(H2,18,20,21,22)