4-[2-[4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-1,4-benzoxazin-3-one

Systemtic Name: 4-[2-[4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-1,4-benzoxazin-3-one Openeye Name: 4-[2-[4-(benzothiophen-3-ylmethyl)piperazin-1-yl]-2-oxo-ethyl]-1,4-benzoxazin-3-one CAS Name: 4-[2-[4-(1-benzothiophen-3-ylmethyl)-1-piperazinyl]-2-oxoethyl]-1,4-benzoxazin-3-one IUPAC Name: 4-[2-[4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]-2-oxoethyl]-1,4-benzoxazin-3-one Traditional Name: 4-[2-[4-(benzothiophen-3-ylmethyl)piperazino]-2-keto-ethyl]-1,4-benzoxazin-3-one Formula: C23H23N3O3S MolecularWeight: 421.51202

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CSC3=CC=CC=C32)C(=O)CN4C(=O)COC5=CC=CC=C54

Isomeric SMILES

C1CN(CCN1CC2=CSC3=CC=CC=C32)C(=O)CN4C(=O)COC5=CC=CC=C54

InChI

InChI=1S/C23H23N3O3S/c27-22(14-26-19-6-2-3-7-20(19)29-15-23(26)28)25-11-9-24(10-12-25)13-17-16-30-21-8-4-1-5-18(17)21/h1-8,16H,9-15H2