6-[(4-methylpiperazin-1-yl)methyl]-3-(5-pent-1-ynylthiophen-3-yl)-1,4-dihydroindeno[1,2-c]pyrazole

Systemtic Name: 6-[(4-methylpiperazin-1-yl)methyl]-3-(5-pent-1-ynylthiophen-3-yl)-1,4-dihydroindeno[1,2-c]pyrazole Openeye Name: 6-[(4-methylpiperazin-1-yl)methyl]-3-(5-pent-1-ynyl-3-thienyl)-1,4-dihydroindeno[1,2-c]pyrazole CAS Name: 6-[(4-methyl-1-piperazinyl)methyl]-3-(5-pent-1-ynyl-3-thiophenyl)-1,4-dihydroindeno[1,2-c]pyrazole IUPAC Name: 6-[(4-methylpiperazin-1-yl)methyl]-3-(5-pent-1-ynylthiophen-3-yl)-1,4-dihydroindeno[1,2-c]pyrazole Traditional Name: 6-[(4-methylpiperazino)methyl]-3-(5-pent-1-ynyl-3-thienyl)-1,4-dihydroindeno[1,2-c]pyrazole Formula: C25H28N4S MolecularWeight: 416.58162

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Descriptors Computed from Structure

Canonical SMILES:

CCCC#CC1=CC(=CS1)C2=NNC3=C2CC4=C3C=CC(=C4)CN5CCN(CC5)C

Isomeric SMILES

CCCC#CC1=CC(=CS1)C2=NNC3=C2CC4=C3C=CC(=C4)CN5CCN(CC5)C

InChI

InChI=1S/C25H28N4S/c1-3-4-5-6-21-14-20(17-30-21)24-23-15-19-13-18(7-8-22(19)25(23)27-26-24)16-29-11-9-28(2)10-12-29/h7-8,13-14,17H,3-4,9-12,15-16H2,1-2H3,(H,26,27)