2-oxidanyl-7-[3-[4-(quinolin-2-ylmethyl)piperazin-1-yl]propoxy]-4H-1,4-benzothiazin-3-one

Systemtic Name: 2-oxidanyl-7-[3-[4-(quinolin-2-ylmethyl)piperazin-1-yl]propoxy]-4H-1,4-benzothiazin-3-one Openeye Name: 2-hydroxy-7-[3-[4-(2-quinolylmethyl)piperazin-1-yl]propoxy]-4H-1,4-benzothiazin-3-one CAS Name: 2-hydroxy-7-[3-[4-(2-quinolinylmethyl)-1-piperazinyl]propoxy]-4H-1,4-benzothiazin-3-one IUPAC Name: 2-hydroxy-7-[3-[4-(quinolin-2-ylmethyl)piperazin-1-yl]propoxy]-4H-1,4-benzothiazin-3-one Traditional Name: 2-hydroxy-7-[3-[4-(2-quinolylmethyl)piperazino]propoxy]-4H-1,4-benzothiazin-3-one Formula: C25H28N4O3S MolecularWeight: 464.57982

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCOC2=CC3=C(C=C2)NC(=O)C(S3)O)CC4=NC5=CC=CC=C5C=C4

Isomeric SMILES

C1CN(CCN1CCCOC2=CC3=C(C=C2)NC(=O)C(S3)O)CC4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C25H28N4O3S/c30-24-25(31)33-23-16-20(8-9-22(23)27-24)32-15-3-10-28-11-13-29(14-12-28)17-19-7-6-18-4-1-2-5-21(18)26-19/h1-2,4-9,16,25,31H,3,10-15,17H2,(H,27,30)