2-[[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]methyl]-1H-quinazolin-4-one Openeye Name: 2-[[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]methyl]-1H-quinazolin-4-one CAS Name: 2-[[4-(1,3-benzothiazol-2-ylmethyl)-1-piperazinyl]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]methyl]-1H-quinazolin-4-one Traditional Name: 2-[[4-(1,3-benzothiazol-2-ylmethyl)piperazino]methyl]-1H-quinazolin-4-one Formula: C21H21N5OS MolecularWeight: 391.48934

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC(=O)C3=CC=CC=C3N2)CC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CN(CCN1CC2=NC(=O)C3=CC=CC=C3N2)CC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C21H21N5OS/c27-21-15-5-1-2-6-16(15)22-19(24-21)13-25-9-11-26(12-10-25)14-20-23-17-7-3-4-8-18(17)28-20/h1-8H,9-14H2,(H,22,24,27)