[5,6-dimethyl-4-(4-phenylpiperazin-1-yl)thieno[2,3-d]pyrimidin-2-yl]methyl-diethyl-azanium

Systemtic Name: [5,6-dimethyl-4-(4-phenylpiperazin-1-yl)thieno[2,3-d]pyrimidin-2-yl]methyl-diethyl-azanium Openeye Name: [5,6-dimethyl-4-(4-phenylpiperazin-1-yl)thieno[2,3-d]pyrimidin-2-yl]methyl-diethyl-ammonium CAS Name: [5,6-dimethyl-4-(4-phenyl-1-piperazinyl)-2-thieno[2,3-d]pyrimidinyl]methyl-diethylammonium IUPAC Name: [5,6-dimethyl-4-(4-phenylpiperazin-1-yl)thieno[2,3-d]pyrimidin-2-yl]methyl-diethylazanium Traditional Name: [5,6-dimethyl-4-(4-phenylpiperazino)thieno[2,3-d]pyrimidin-2-yl]methyl-diethyl-ammonium Formula: C23H32N5S+ MolecularWeight: 410.59868

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=NC(=C2C(=C(SC2=N1)C)C)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC[NH+](CC)CC1=NC(=C2C(=C(SC2=N1)C)C)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C23H31N5S/c1-5-26(6-2)16-20-24-22(21-17(3)18(4)29-23(21)25-20)28-14-12-27(13-15-28)19-10-8-7-9-11-19/h7-11H,5-6,12-16H2,1-4H3/p+1