4-[(2-methylphenyl)methylsulfanyl]-6-(4-phenylpiperazin-1-yl)pyrimidine

Systemtic Name: 4-[(2-methylphenyl)methylsulfanyl]-6-(4-phenylpiperazin-1-yl)pyrimidine Openeye Name: 4-(o-tolylmethylsulfanyl)-6-(4-phenylpiperazin-1-yl)pyrimidine CAS Name: 4-[(2-methylphenyl)methylthio]-6-(4-phenyl-1-piperazinyl)pyrimidine IUPAC Name: 4-[(2-methylphenyl)methylsulfanyl]-6-(4-phenylpiperazin-1-yl)pyrimidine Traditional Name: 4-[(2-methylbenzyl)thio]-6-(4-phenylpiperazino)pyrimidine Formula: C22H24N4S MolecularWeight: 376.51776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NC=NC(=C2)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1CSC2=NC=NC(=C2)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C22H24N4S/c1-18-7-5-6-8-19(18)16-27-22-15-21(23-17-24-22)26-13-11-25(12-14-26)20-9-3-2-4-10-20/h2-10,15,17H,11-14,16H2,1H3