7-[4-[4-(1-oxidanylidene-1-benzothiophen-4-yl)piperazin-1-yl]butoxy]-1H-quinolin-2-one

Systemtic Name: 7-[4-[4-(1-oxidanylidene-1-benzothiophen-4-yl)piperazin-1-yl]butoxy]-1H-quinolin-2-one Openeye Name: 7-[4-[4-(1-oxobenzothiophen-4-yl)piperazin-1-yl]butoxy]-1H-quinolin-2-one CAS Name: 7-[4-[4-(1-oxo-1-benzothiophen-4-yl)-1-piperazinyl]butoxy]-1H-quinolin-2-one IUPAC Name: 7-[4-[4-(1-oxo-1-benzothiophen-4-yl)piperazin-1-yl]butoxy]-1H-quinolin-2-one Traditional Name: 7-[4-[4-(1-ketobenzothiophen-4-yl)piperazino]butoxy]carbostyril Formula: C25H27N3O3S MolecularWeight: 449.56518

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCOC2=CC3=C(C=C2)C=CC(=O)N3)C4=C5C=CS(=O)C5=CC=C4

Isomeric SMILES

C1CN(CCN1CCCCOC2=CC3=C(C=C2)C=CC(=O)N3)C4=C5C=CS(=O)C5=CC=C4

InChI

InChI=1S/C25H27N3O3S/c29-25-9-7-19-6-8-20(18-22(19)26-25)31-16-2-1-11-27-12-14-28(15-13-27)23-4-3-5-24-21(23)10-17-32(24)30/h3-10,17-18H,1-2,11-16H2,(H,26,29)