1-[3-[[4-azanyl-6-(dimethylamino)-1,3,5-triazin-2-yl]methylsulfanylmethyl]-4-ethoxy-phenyl]ethanone

Systemtic Name: 1-[3-[[4-azanyl-6-(dimethylamino)-1,3,5-triazin-2-yl]methylsulfanylmethyl]-4-ethoxy-phenyl]ethanone Openeye Name: 1-[3-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methylsulfanylmethyl]-4-ethoxy-phenyl]ethanone CAS Name: 1-[3-[[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methylthio]methyl]-4-ethoxyphenyl]ethanone IUPAC Name: 1-[3-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methylsulfanylmethyl]-4-ethoxyphenyl]ethanone Traditional Name: 1-[3-[[[4-amino-6-(dimethylamino)-s-triazin-2-yl]methylthio]methyl]-4-ethoxy-phenyl]ethanone Formula: C17H23N5O2S MolecularWeight: 361.46182

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C)CSCC2=NC(=NC(=N2)N(C)C)N

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)CSCC2=NC(=NC(=N2)N(C)C)N

InChI

InChI=1S/C17H23N5O2S/c1-5-24-14-7-6-12(11(2)23)8-13(14)9-25-10-15-19-16(18)21-17(20-15)22(3)4/h6-8H,5,9-10H2,1-4H3,(H2,18,19,20,21)