2-methyl-N-[(2R)-3-methyl-2-(4-methylpiperazin-1-ium-1-yl)butyl]-5-phenyl-thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: 2-methyl-N-[(2R)-3-methyl-2-(4-methylpiperazin-1-ium-1-yl)butyl]-5-phenyl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: 2-methyl-N-[(2R)-3-methyl-2-(4-methylpiperazin-1-ium-1-yl)butyl]-5-phenyl-thieno[2,3-d]pyrimidin-4-amine CAS Name: 2-methyl-N-[(2R)-3-methyl-2-(4-methyl-1-piperazin-1-iumyl)butyl]-5-phenyl-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 2-methyl-N-[(2R)-3-methyl-2-(4-methylpiperazin-1-ium-1-yl)butyl]-5-phenylthieno[2,3-d]pyrimidin-4-amine Traditional Name: [(2R)-3-methyl-2-(4-methylpiperazin-1-ium-1-yl)butyl]-(2-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)amine Formula: C23H32N5S+ MolecularWeight: 410.59868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C2C(=CSC2=N1)C3=CC=CC=C3)NCC(C(C)C)[NH+]4CCN(CC4)C

Isomeric SMILES

CC1=NC(=C2C(=CSC2=N1)C3=CC=CC=C3)NC[C@@H](C(C)C)[NH+]4CCN(CC4)C

InChI

InChI=1S/C23H31N5S/c1-16(2)20(28-12-10-27(4)11-13-28)14-24-22-21-19(18-8-6-5-7-9-18)15-29-23(21)26-17(3)25-22/h5-9,15-16,20H,10-14H2,1-4H3,(H,24,25,26)/p+1/t20-/m0/s1