7-[3-[4-[(8-phenylmethoxyquinolin-2-yl)methyl]piperazin-1-yl]propoxy]-4H-1,4-benzothiazin-3-one

Systemtic Name: 7-[3-[4-[(8-phenylmethoxyquinolin-2-yl)methyl]piperazin-1-yl]propoxy]-4H-1,4-benzothiazin-3-one Openeye Name: 7-[3-[4-[(8-benzyloxy-2-quinolyl)methyl]piperazin-1-yl]propoxy]-4H-1,4-benzothiazin-3-one CAS Name: 7-[3-[4-[(8-phenylmethoxy-2-quinolinyl)methyl]-1-piperazinyl]propoxy]-4H-1,4-benzothiazin-3-one IUPAC Name: 7-[3-[4-[(8-phenylmethoxyquinolin-2-yl)methyl]piperazin-1-yl]propoxy]-4H-1,4-benzothiazin-3-one Traditional Name: 7-[3-[4-[(8-benzoxy-2-quinolyl)methyl]piperazino]propoxy]-4H-1,4-benzothiazin-3-one Formula: C32H34N4O3S MolecularWeight: 554.70236

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCOC2=CC3=C(C=C2)NC(=O)CS3)CC4=NC5=C(C=CC=C5OCC6=CC=CC=C6)C=C4

Isomeric SMILES

C1CN(CCN1CCCOC2=CC3=C(C=C2)NC(=O)CS3)CC4=NC5=C(C=CC=C5OCC6=CC=CC=C6)C=C4

InChI

InChI=1S/C32H34N4O3S/c37-31-23-40-30-20-27(12-13-28(30)34-31)38-19-5-14-35-15-17-36(18-16-35)21-26-11-10-25-8-4-9-29(32(25)33-26)39-22-24-6-2-1-3-7-24/h1-4,6-13,20H,5,14-19,21-23H2,(H,34,37)