3-[[5-methyl-4-[3-(4-methylphenyl)-5-methylsulfanyl-thiophen-2-yl]pyrimidin-2-yl]amino]phenol

Systemtic Name: 3-[[5-methyl-4-[3-(4-methylphenyl)-5-methylsulfanyl-thiophen-2-yl]pyrimidin-2-yl]amino]phenol Openeye Name: 3-[[5-methyl-4-[5-methylsulfanyl-3-(p-tolyl)-2-thienyl]pyrimidin-2-yl]amino]phenol CAS Name: 3-[[5-methyl-4-[3-(4-methylphenyl)-5-(methylthio)-2-thiophenyl]-2-pyrimidinyl]amino]phenol IUPAC Name: 3-[[5-methyl-4-[3-(4-methylphenyl)-5-methylsulfanylthiophen-2-yl]pyrimidin-2-yl]amino]phenol Traditional Name: 3-[[5-methyl-4-[5-(methylthio)-3-(p-tolyl)-2-thienyl]pyrimidin-2-yl]amino]phenol Formula: C23H21N3OS2 MolecularWeight: 419.56234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(SC(=C2)SC)C3=NC(=NC=C3C)NC4=CC(=CC=C4)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(SC(=C2)SC)C3=NC(=NC=C3C)NC4=CC(=CC=C4)O

InChI

InChI=1S/C23H21N3OS2/c1-14-7-9-16(10-8-14)19-12-20(28-3)29-22(19)21-15(2)13-24-23(26-21)25-17-5-4-6-18(27)11-17/h4-13,27H,1-3H3,(H,24,25,26)