7-[4-[4-(1-methylpyrrolo[3,2-c]pyridin-4-yl)piperazin-1-yl]butyl]-9-thia-7-azaspiro[4.4]nonane-6,8-dione

Systemtic Name: 7-[4-[4-(1-methylpyrrolo[3,2-c]pyridin-4-yl)piperazin-1-yl]butyl]-9-thia-7-azaspiro[4.4]nonane-6,8-dione Openeye Name: 7-[4-[4-(1-methylpyrrolo[3,2-c]pyridin-4-yl)piperazin-1-yl]butyl]-9-thia-7-azaspiro[4.4]nonane-6,8-dione CAS Name: 7-[4-[4-(1-methyl-4-pyrrolo[3,2-c]pyridinyl)-1-piperazinyl]butyl]-9-thia-7-azaspiro[4.4]nonane-6,8-dione IUPAC Name: 7-[4-[4-(1-methylpyrrolo[3,2-c]pyridin-4-yl)piperazin-1-yl]butyl]-9-thia-7-azaspiro[4.4]nonane-6,8-dione Traditional Name: 7-[4-[4-(1-methylpyrrolo[3,2-c]pyridin-4-yl)piperazino]butyl]-9-thia-7-azaspiro[4.4]nonane-6,8-quinone Formula: C23H31N5O2S MolecularWeight: 441.58954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC2=C1C=CN=C2N3CCN(CC3)CCCCN4C(=O)C5(CCCC5)SC4=O

Isomeric SMILES

CN1C=CC2=C1C=CN=C2N3CCN(CC3)CCCCN4C(=O)C5(CCCC5)SC4=O

InChI

InChI=1S/C23H31N5O2S/c1-25-13-7-18-19(25)6-10-24-20(18)27-16-14-26(15-17-27)11-4-5-12-28-21(29)23(31-22(28)30)8-2-3-9-23/h6-7,10,13H,2-5,8-9,11-12,14-17H2,1H3