N-(9H-fluoren-9-yl)-5-methyl-4-(4-methylpiperazin-4-ium-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N-(9H-fluoren-9-yl)-5-methyl-4-(4-methylpiperazin-4-ium-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-(9H-fluoren-9-yl)-5-methyl-4-(4-methylpiperazin-4-ium-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(9H-fluoren-9-yl)-5-methyl-4-(4-methyl-1-piperazin-4-iumyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-(9H-fluoren-9-yl)-5-methyl-4-(4-methylpiperazin-4-ium-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(9H-fluoren-9-yl)-5-methyl-4-(4-methylpiperazin-4-ium-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C26H26N5OS+ MolecularWeight: 456.58254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)N3CC[NH+](CC3)C)C(=O)NC4C5=CC=CC=C5C6=CC=CC=C46

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)N3CC[NH+](CC3)C)C(=O)NC4C5=CC=CC=C5C6=CC=CC=C46

InChI

InChI=1S/C26H25N5OS/c1-16-21-24(31-13-11-30(2)12-14-31)27-15-28-26(21)33-23(16)25(32)29-22-19-9-5-3-7-17(19)18-8-4-6-10-20(18)22/h3-10,15,22H,11-14H2,1-2H3,(H,29,32)/p+1