N,N-dimethyl-4-[4-morpholin-4-yl-6-(piperazin-1-ylmethyl)thieno[2,3-d]pyrimidin-2-yl]-1H-indole-6-sulfonamide

Systemtic Name: N,N-dimethyl-4-[4-morpholin-4-yl-6-(piperazin-1-ylmethyl)thieno[2,3-d]pyrimidin-2-yl]-1H-indole-6-sulfonamide Openeye Name: N,N-dimethyl-4-[4-morpholino-6-(piperazin-1-ylmethyl)thieno[2,3-d]pyrimidin-2-yl]-1H-indole-6-sulfonamide CAS Name: N,N-dimethyl-4-[4-(4-morpholinyl)-6-(1-piperazinylmethyl)-2-thieno[2,3-d]pyrimidinyl]-1H-indole-6-sulfonamide IUPAC Name: N,N-dimethyl-4-[4-morpholin-4-yl-6-(piperazin-1-ylmethyl)thieno[2,3-d]pyrimidin-2-yl]-1H-indole-6-sulfonamide Traditional Name: N,N-dimethyl-4-[4-morpholino-6-(piperazinomethyl)thieno[2,3-d]pyrimidin-2-yl]-1H-indole-6-sulfonamide Formula: C25H31N7O3S2 MolecularWeight: 541.68874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC2=C(C=CN2)C(=C1)C3=NC(=C4C=C(SC4=N3)CN5CCNCC5)N6CCOCC6

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC2=C(C=CN2)C(=C1)C3=NC(=C4C=C(SC4=N3)CN5CCNCC5)N6CCOCC6

InChI

InChI=1S/C25H31N7O3S2/c1-30(2)37(33,34)18-14-20(19-3-4-27-22(19)15-18)23-28-24(32-9-11-35-12-10-32)21-13-17(36-25(21)29-23)16-31-7-5-26-6-8-31/h3-4,13-15,26-27H,5-12,16H2,1-2H3