2-methyl-5-phenyl-4-[4-(quinolin-8-ylmethyl)piperazin-1-yl]thieno[2,3-d]pyrimidine

Systemtic Name: 2-methyl-5-phenyl-4-[4-(quinolin-8-ylmethyl)piperazin-1-yl]thieno[2,3-d]pyrimidine Openeye Name: 2-methyl-5-phenyl-4-[4-(8-quinolylmethyl)piperazin-1-yl]thieno[2,3-d]pyrimidine CAS Name: 2-methyl-5-phenyl-4-[4-(8-quinolinylmethyl)-1-piperazinyl]thieno[2,3-d]pyrimidine IUPAC Name: 2-methyl-5-phenyl-4-[4-(quinolin-8-ylmethyl)piperazin-1-yl]thieno[2,3-d]pyrimidine Traditional Name: 2-methyl-5-phenyl-4-[4-(8-quinolylmethyl)piperazino]thieno[2,3-d]pyrimidine Formula: C27H25N5S MolecularWeight: 451.5859

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C2C(=CSC2=N1)C3=CC=CC=C3)N4CCN(CC4)CC5=CC=CC6=C5N=CC=C6

Isomeric SMILES

CC1=NC(=C2C(=CSC2=N1)C3=CC=CC=C3)N4CCN(CC4)CC5=CC=CC6=C5N=CC=C6

InChI

InChI=1S/C27H25N5S/c1-19-29-26(24-23(18-33-27(24)30-19)20-7-3-2-4-8-20)32-15-13-31(14-16-32)17-22-10-5-9-21-11-6-12-28-25(21)22/h2-12,18H,13-17H2,1H3