1-[4-azanyl-6-[(4-methoxyphenyl)amino]-1,3,5-triazin-2-yl]-3-(4-methylphenyl)sulfanyl-propan-2-one

Systemtic Name: 1-[4-azanyl-6-[(4-methoxyphenyl)amino]-1,3,5-triazin-2-yl]-3-(4-methylphenyl)sulfanyl-propan-2-one Openeye Name: 1-[4-amino-6-(4-methoxyanilino)-1,3,5-triazin-2-yl]-3-(p-tolylsulfanyl)propan-2-one CAS Name: 1-[4-amino-6-(4-methoxyanilino)-1,3,5-triazin-2-yl]-3-[(4-methylphenyl)thio]-2-propanone IUPAC Name: 1-[4-amino-6-(4-methoxyanilino)-1,3,5-triazin-2-yl]-3-(4-methylphenyl)sulfanylpropan-2-one Traditional Name: 1-[4-amino-6-(p-anisidino)-s-triazin-2-yl]-3-(p-tolylthio)acetone Formula: C20H21N5O2S MolecularWeight: 395.47804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(=O)CC2=NC(=NC(=N2)NC3=CC=C(C=C3)OC)N

Isomeric SMILES

CC1=CC=C(C=C1)SCC(=O)CC2=NC(=NC(=N2)NC3=CC=C(C=C3)OC)N

InChI

InChI=1S/C20H21N5O2S/c1-13-3-9-17(10-4-13)28-12-15(26)11-18-23-19(21)25-20(24-18)22-14-5-7-16(27-2)8-6-14/h3-10H,11-12H2,1-2H3,(H3,21,22,23,24,25)