1-(3-chlorophenyl)-4-[(3-methylthiophen-2-yl)methyl]piperazin-4-ium

Systemtic Name: 1-(3-chlorophenyl)-4-[(3-methylthiophen-2-yl)methyl]piperazin-4-ium Openeye Name: 1-(3-chlorophenyl)-4-[(3-methyl-2-thienyl)methyl]piperazin-4-ium CAS Name: 1-(3-chlorophenyl)-4-[(3-methyl-2-thiophenyl)methyl]piperazin-4-ium IUPAC Name: 1-(3-chlorophenyl)-4-[(3-methylthiophen-2-yl)methyl]piperazin-4-ium Traditional Name: 1-(3-chlorophenyl)-4-[(3-methyl-2-thienyl)methyl]piperazin-4-ium Formula: C16H20ClN2S+ MolecularWeight: 307.8614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C[NH+]2CCN(CC2)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=C(SC=C1)C[NH+]2CCN(CC2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C16H19ClN2S/c1-13-5-10-20-16(13)12-18-6-8-19(9-7-18)15-4-2-3-14(17)11-15/h2-5,10-11H,6-9,12H2,1H3/p+1