4-azanyl-2-[[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]methyl]isoindole-1,3-dione

Systemtic Name: 4-azanyl-2-[[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]methyl]isoindole-1,3-dione Openeye Name: 4-amino-2-[[4-(1,3-benzothiazol-2-yl)-1-piperidyl]methyl]isoindoline-1,3-dione CAS Name: 4-amino-2-[[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]methyl]isoindole-1,3-dione IUPAC Name: 4-amino-2-[[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]methyl]isoindole-1,3-dione Traditional Name: 4-amino-2-[[4-(1,3-benzothiazol-2-yl)piperidino]methyl]isoindoline-1,3-quinone Formula: C21H20N4O2S MolecularWeight: 392.4741

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC3=CC=CC=C3S2)CN4C(=O)C5=C(C4=O)C(=CC=C5)N

Isomeric SMILES

C1CN(CCC1C2=NC3=CC=CC=C3S2)CN4C(=O)C5=C(C4=O)C(=CC=C5)N

InChI

InChI=1S/C21H20N4O2S/c22-15-5-3-4-14-18(15)21(27)25(20(14)26)12-24-10-8-13(9-11-24)19-23-16-6-1-2-7-17(16)28-19/h1-7,13H,8-12,22H2