4-[4-[4-(4-nitrophenyl)piperazin-1-yl]-4-oxidanylidene-butyl]-1,4-benzothiazin-3-one

Systemtic Name: 4-[4-[4-(4-nitrophenyl)piperazin-1-yl]-4-oxidanylidene-butyl]-1,4-benzothiazin-3-one Openeye Name: 4-[4-[4-(4-nitrophenyl)piperazin-1-yl]-4-oxo-butyl]-1,4-benzothiazin-3-one CAS Name: 4-[4-[4-(4-nitrophenyl)-1-piperazinyl]-4-oxobutyl]-1,4-benzothiazin-3-one IUPAC Name: 4-[4-[4-(4-nitrophenyl)piperazin-1-yl]-4-oxobutyl]-1,4-benzothiazin-3-one Traditional Name: 4-[4-keto-4-[4-(4-nitrophenyl)piperazino]butyl]-1,4-benzothiazin-3-one Formula: C22H24N4O4S MolecularWeight: 440.51536

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)CCCN3C(=O)CSC4=CC=CC=C43

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)CCCN3C(=O)CSC4=CC=CC=C43

InChI

InChI=1S/C22H24N4O4S/c27-21(6-3-11-25-19-4-1-2-5-20(19)31-16-22(25)28)24-14-12-23(13-15-24)17-7-9-18(10-8-17)26(29)30/h1-2,4-5,7-10H,3,6,11-16H2