2-methyl-4-[5-(4-phenethylpiperazin-4-ium-1-yl)sulfonylthiophen-2-yl]-1,3-thiazole

Systemtic Name: 2-methyl-4-[5-(4-phenethylpiperazin-4-ium-1-yl)sulfonylthiophen-2-yl]-1,3-thiazole Openeye Name: 2-methyl-4-[5-(4-phenethylpiperazin-4-ium-1-yl)sulfonyl-2-thienyl]thiazole CAS Name: 2-methyl-4-[5-[(4-phenethyl-1-piperazin-4-iumyl)sulfonyl]-2-thiophenyl]thiazole IUPAC Name: 2-methyl-4-[5-(4-phenethylpiperazin-4-ium-1-yl)sulfonylthiophen-2-yl]-1,3-thiazole Traditional Name: 2-methyl-4-[5-(4-phenethylpiperazin-4-ium-1-yl)sulfonyl-2-thienyl]thiazole Formula: C20H24N3O2S3+ MolecularWeight: 434.61846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC=C(S2)S(=O)(=O)N3CC[NH+](CC3)CCC4=CC=CC=C4

Isomeric SMILES

CC1=NC(=CS1)C2=CC=C(S2)S(=O)(=O)N3CC[NH+](CC3)CCC4=CC=CC=C4

InChI

InChI=1S/C20H23N3O2S3/c1-16-21-18(15-26-16)19-7-8-20(27-19)28(24,25)23-13-11-22(12-14-23)10-9-17-5-3-2-4-6-17/h2-8,15H,9-14H2,1H3/p+1