4-[6-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]pyridin-3-yl]sulfonylmorpholine

Systemtic Name: 4-[6-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]pyridin-3-yl]sulfonylmorpholine Openeye Name: 4-[[6-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-3-pyridyl]sulfonyl]morpholine CAS Name: 4-[[6-[4-(1,3-benzothiazol-2-ylmethyl)-1-piperazinyl]-3-pyridinyl]sulfonyl]morpholine IUPAC Name: 4-[6-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]pyridin-3-yl]sulfonylmorpholine Traditional Name: 4-[[6-[4-(1,3-benzothiazol-2-ylmethyl)piperazino]-3-pyridyl]sulfonyl]morpholine Formula: C21H25N5O3S2 MolecularWeight: 459.5849

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC3=CC=CC=C3S2)C4=NC=C(C=C4)S(=O)(=O)N5CCOCC5

Isomeric SMILES

C1CN(CCN1CC2=NC3=CC=CC=C3S2)C4=NC=C(C=C4)S(=O)(=O)N5CCOCC5

InChI

InChI=1S/C21H25N5O3S2/c27-31(28,26-11-13-29-14-12-26)17-5-6-20(22-15-17)25-9-7-24(8-10-25)16-21-23-18-3-1-2-4-19(18)30-21/h1-6,15H,7-14,16H2