4-[[4-(3-chlorophenyl)-5-(5-methyl-2-phenylazanyl-pyrimidin-4-yl)thiophen-2-yl]sulfanylmethyl]phenol

Systemtic Name: 4-[[4-(3-chlorophenyl)-5-(5-methyl-2-phenylazanyl-pyrimidin-4-yl)thiophen-2-yl]sulfanylmethyl]phenol Openeye Name: 4-[[5-(2-anilino-5-methyl-pyrimidin-4-yl)-4-(3-chlorophenyl)-2-thienyl]sulfanylmethyl]phenol CAS Name: 4-[[[5-(2-anilino-5-methyl-4-pyrimidinyl)-4-(3-chlorophenyl)-2-thiophenyl]thio]methyl]phenol IUPAC Name: 4-[[5-(2-anilino-5-methylpyrimidin-4-yl)-4-(3-chlorophenyl)thiophen-2-yl]sulfanylmethyl]phenol Traditional Name: 4-[[[5-(2-anilino-5-methyl-pyrimidin-4-yl)-4-(3-chlorophenyl)-2-thienyl]thio]methyl]phenol Formula: C28H22ClN3OS2 MolecularWeight: 516.07678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N=C1C2=C(C=C(S2)SCC3=CC=C(C=C3)O)C4=CC(=CC=C4)Cl)NC5=CC=CC=C5

Isomeric SMILES

CC1=CN=C(N=C1C2=C(C=C(S2)SCC3=CC=C(C=C3)O)C4=CC(=CC=C4)Cl)NC5=CC=CC=C5

InChI

InChI=1S/C28H22ClN3OS2/c1-18-16-30-28(31-22-8-3-2-4-9-22)32-26(18)27-24(20-6-5-7-21(29)14-20)15-25(35-27)34-17-19-10-12-23(33)13-11-19/h2-16,33H,17H2,1H3,(H,30,31,32)