2-[5-methyl-2-phenyl-4-(4-phenylpiperazin-1-yl)thieno[2,3-d]pyrimidin-6-yl]-1H-quinazolin-4-one

Systemtic Name: 2-[5-methyl-2-phenyl-4-(4-phenylpiperazin-1-yl)thieno[2,3-d]pyrimidin-6-yl]-1H-quinazolin-4-one Openeye Name: 2-[5-methyl-2-phenyl-4-(4-phenylpiperazin-1-yl)thieno[2,3-d]pyrimidin-6-yl]-1H-quinazolin-4-one CAS Name: 2-[5-methyl-2-phenyl-4-(4-phenyl-1-piperazinyl)-6-thieno[2,3-d]pyrimidinyl]-1H-quinazolin-4-one IUPAC Name: 2-[5-methyl-2-phenyl-4-(4-phenylpiperazin-1-yl)thieno[2,3-d]pyrimidin-6-yl]-1H-quinazolin-4-one Traditional Name: 2-[5-methyl-2-phenyl-4-(4-phenylpiperazino)thieno[2,3-d]pyrimidin-6-yl]-1H-quinazolin-4-one Formula: C31H26N6OS MolecularWeight: 530.64274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)N3CCN(CC3)C4=CC=CC=C4)C5=CC=CC=C5)C6=NC(=O)C7=CC=CC=C7N6

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)N3CCN(CC3)C4=CC=CC=C4)C5=CC=CC=C5)C6=NC(=O)C7=CC=CC=C7N6

InChI

InChI=1S/C31H26N6OS/c1-20-25-29(37-18-16-36(17-19-37)22-12-6-3-7-13-22)33-27(21-10-4-2-5-11-21)35-31(25)39-26(20)28-32-24-15-9-8-14-23(24)30(38)34-28/h2-15H,16-19H2,1H3,(H,32,34,38)