2-methyl-3-[(R)-(4-phenylpiperazin-1-ium-1-yl)-thiophen-2-yl-methyl]-1H-indole

Systemtic Name: 2-methyl-3-[(R)-(4-phenylpiperazin-1-ium-1-yl)-thiophen-2-yl-methyl]-1H-indole Openeye Name: 2-methyl-3-[(R)-(4-phenylpiperazin-1-ium-1-yl)-(2-thienyl)methyl]-1H-indole CAS Name: 2-methyl-3-[(R)-(4-phenyl-1-piperazin-1-iumyl)-thiophen-2-ylmethyl]-1H-indole IUPAC Name: 2-methyl-3-[(R)-(4-phenylpiperazin-1-ium-1-yl)-thiophen-2-ylmethyl]-1H-indole Traditional Name: 2-methyl-3-[(R)-(4-phenylpiperazin-1-ium-1-yl)-(2-thienyl)methyl]-1H-indole Formula: C24H26N3S+ MolecularWeight: 388.54834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(C3=CC=CS3)[NH+]4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)[C@H](C3=CC=CS3)[NH+]4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C24H25N3S/c1-18-23(20-10-5-6-11-21(20)25-18)24(22-12-7-17-28-22)27-15-13-26(14-16-27)19-8-3-2-4-9-19/h2-12,17,24-25H,13-16H2,1H3/p+1/t24-/m0/s1