2-[(4-thieno[2,3-d]pyrimidin-4-ylpiperazin-1-yl)methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[(4-thieno[2,3-d]pyrimidin-4-ylpiperazin-1-yl)methyl]-1H-quinazolin-4-one Openeye Name: 2-[(4-thieno[2,3-d]pyrimidin-4-ylpiperazin-1-yl)methyl]-1H-quinazolin-4-one CAS Name: 2-[[4-(4-thieno[2,3-d]pyrimidinyl)-1-piperazinyl]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[(4-thieno[2,3-d]pyrimidin-4-ylpiperazin-1-yl)methyl]-1H-quinazolin-4-one Traditional Name: 2-[(4-thieno[2,3-d]pyrimidin-4-ylpiperazino)methyl]-1H-quinazolin-4-one Formula: C19H18N6OS MolecularWeight: 378.45082

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC(=O)C3=CC=CC=C3N2)C4=C5C=CSC5=NC=N4

Isomeric SMILES

C1CN(CCN1CC2=NC(=O)C3=CC=CC=C3N2)C4=C5C=CSC5=NC=N4

InChI

InChI=1S/C19H18N6OS/c26-18-13-3-1-2-4-15(13)22-16(23-18)11-24-6-8-25(9-7-24)17-14-5-10-27-19(14)21-12-20-17/h1-5,10,12H,6-9,11H2,(H,22,23,26)