[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-4-ium-1-yl]-(1-thiophen-2-ylsulfonylpiperidin-4-yl)methanone

Systemtic Name: [4-[(5-chloranylthiophen-2-yl)methyl]piperazin-4-ium-1-yl]-(1-thiophen-2-ylsulfonylpiperidin-4-yl)methanone Openeye Name: [4-[(5-chloro-2-thienyl)methyl]piperazin-4-ium-1-yl]-[1-(2-thienylsulfonyl)-4-piperidyl]methanone CAS Name: [4-[(5-chloro-2-thiophenyl)methyl]-1-piperazin-4-iumyl]-(1-thiophen-2-ylsulfonyl-4-piperidinyl)methanone IUPAC Name: [4-[(5-chlorothiophen-2-yl)methyl]piperazin-4-ium-1-yl]-(1-thiophen-2-ylsulfonylpiperidin-4-yl)methanone Traditional Name: [4-[(5-chloro-2-thienyl)methyl]piperazin-4-ium-1-yl]-[1-(2-thienylsulfonyl)-4-piperidyl]methanone Formula: C19H25ClN3O3S3+ MolecularWeight: 475.0681

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CC[NH+](CC2)CC3=CC=C(S3)Cl)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCC1C(=O)N2CC[NH+](CC2)CC3=CC=C(S3)Cl)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C19H24ClN3O3S3/c20-17-4-3-16(28-17)14-21-9-11-22(12-10-21)19(24)15-5-7-23(8-6-15)29(25,26)18-2-1-13-27-18/h1-4,13,15H,5-12,14H2/p+1