N'-[3-(4-phenylpiperazin-1-ium-1-yl)propanoyl]-5,6-dihydro-4H-cyclopenta[b]thiophene-2-carbohydrazide

Systemtic Name: N'-[3-(4-phenylpiperazin-1-ium-1-yl)propanoyl]-5,6-dihydro-4H-cyclopenta[b]thiophene-2-carbohydrazide Openeye Name: N'-[3-(4-phenylpiperazin-1-ium-1-yl)propanoyl]-5,6-dihydro-4H-cyclopenta[b]thiophene-2-carbohydrazide CAS Name: N'-[1-oxo-3-(4-phenyl-1-piperazin-1-iumyl)propyl]-5,6-dihydro-4H-cyclopenta[b]thiophene-2-carbohydrazide IUPAC Name: N'-[3-(4-phenylpiperazin-1-ium-1-yl)propanoyl]-5,6-dihydro-4H-cyclopenta[b]thiophene-2-carbohydrazide Traditional Name: N'-[3-(4-phenylpiperazin-1-ium-1-yl)propanoyl]-5,6-dihydro-4H-cyclopenta[b]thiophene-2-carbohydrazide Formula: C21H27N4O2S+ MolecularWeight: 399.52968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)SC(=C2)C(=O)NNC(=O)CC[NH+]3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

C1CC2=C(C1)SC(=C2)C(=O)NNC(=O)CC[NH+]3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C21H26N4O2S/c26-20(22-23-21(27)19-15-16-5-4-8-18(16)28-19)9-10-24-11-13-25(14-12-24)17-6-2-1-3-7-17/h1-3,6-7,15H,4-5,8-14H2,(H,22,26)(H,23,27)/p+1