4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[(2-morpholin-4-ylpyridin-4-yl)methyl]benzamide

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[(2-morpholin-4-ylpyridin-4-yl)methyl]benzamide Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[(2-morpholino-4-pyridyl)methyl]benzamide CAS Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]-N-[[2-(4-morpholinyl)-4-pyridinyl]methyl]benzamide IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[(2-morpholin-4-ylpyridin-4-yl)methyl]benzamide Traditional Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]-N-[(2-morpholino-4-pyridyl)methyl]benzamide Formula: C25H24N4O2S2 MolecularWeight: 476.61366

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC=CC(=C2)CNC(=O)C3=CC=C(C=C3)CSC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1COCCN1C2=NC=CC(=C2)CNC(=O)C3=CC=C(C=C3)CSC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C25H24N4O2S2/c30-24(27-16-19-9-10-26-23(15-19)29-11-13-31-14-12-29)20-7-5-18(6-8-20)17-32-25-28-21-3-1-2-4-22(21)33-25/h1-10,15H,11-14,16-17H2,(H,27,30)