(3-methyl-1-phenyl-thieno[2,3-c]pyrazol-5-yl)-[4-(pyridin-4-ylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: (3-methyl-1-phenyl-thieno[2,3-c]pyrazol-5-yl)-[4-(pyridin-4-ylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: (3-methyl-1-phenyl-thieno[2,3-c]pyrazol-5-yl)-[4-(4-pyridylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: (3-methyl-1-phenyl-5-thieno[2,3-c]pyrazolyl)-[4-(pyridin-4-ylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: (3-methyl-1-phenylthieno[2,3-c]pyrazol-5-yl)-[4-(pyridin-4-ylmethyl)piperazin-4-ium-1-yl]methanone Traditional Name: (3-methyl-1-phenyl-thieno[2,3-c]pyrazol-5-yl)-[4-(4-pyridylmethyl)piperazin-4-ium-1-yl]methanone Formula: C23H24N5OS+ MolecularWeight: 418.53456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)N3CC[NH+](CC3)CC4=CC=NC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)N3CC[NH+](CC3)CC4=CC=NC=C4)C5=CC=CC=C5

InChI

InChI=1S/C23H23N5OS/c1-17-20-15-21(30-23(20)28(25-17)19-5-3-2-4-6-19)22(29)27-13-11-26(12-14-27)16-18-7-9-24-10-8-18/h2-10,15H,11-14,16H2,1H3/p+1