2-[[4-azanyl-6-[(2-ethylphenyl)amino]-1,3,5-triazin-2-yl]methylsulfanyl]-4,6-dimethyl-pyridine-3-carbonitrile

Systemtic Name: 2-[[4-azanyl-6-[(2-ethylphenyl)amino]-1,3,5-triazin-2-yl]methylsulfanyl]-4,6-dimethyl-pyridine-3-carbonitrile Openeye Name: 2-[[4-amino-6-(2-ethylanilino)-1,3,5-triazin-2-yl]methylsulfanyl]-4,6-dimethyl-pyridine-3-carbonitrile CAS Name: 2-[[4-amino-6-(2-ethylanilino)-1,3,5-triazin-2-yl]methylthio]-4,6-dimethyl-3-pyridinecarbonitrile IUPAC Name: 2-[[4-amino-6-(2-ethylanilino)-1,3,5-triazin-2-yl]methylsulfanyl]-4,6-dimethylpyridine-3-carbonitrile Traditional Name: 2-[[4-amino-6-(2-ethylanilino)-s-triazin-2-yl]methylthio]-4,6-dimethyl-nicotinonitrile Formula: C20H21N7S MolecularWeight: 391.49264

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC2=NC(=NC(=N2)N)CSC3=C(C(=CC(=N3)C)C)C#N

Isomeric SMILES

CCC1=CC=CC=C1NC2=NC(=NC(=N2)N)CSC3=C(C(=CC(=N3)C)C)C#N

InChI

InChI=1S/C20H21N7S/c1-4-14-7-5-6-8-16(14)24-20-26-17(25-19(22)27-20)11-28-18-15(10-21)12(2)9-13(3)23-18/h5-9H,4,11H2,1-3H3,(H3,22,24,25,26,27)