[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-4-ium-1-yl]-(1-methylindol-3-yl)methanone

Systemtic Name: [4-[(5-chloranylthiophen-2-yl)methyl]piperazin-4-ium-1-yl]-(1-methylindol-3-yl)methanone Openeye Name: [4-[(5-chloro-2-thienyl)methyl]piperazin-4-ium-1-yl]-(1-methylindol-3-yl)methanone CAS Name: [4-[(5-chloro-2-thiophenyl)methyl]-1-piperazin-4-iumyl]-(1-methyl-3-indolyl)methanone IUPAC Name: [4-[(5-chlorothiophen-2-yl)methyl]piperazin-4-ium-1-yl]-(1-methylindol-3-yl)methanone Traditional Name: [4-[(5-chloro-2-thienyl)methyl]piperazin-4-ium-1-yl]-(1-methylindol-3-yl)methanone Formula: C19H21ClN3OS+ MolecularWeight: 374.90754

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C(=O)N3CC[NH+](CC3)CC4=CC=C(S4)Cl

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)C(=O)N3CC[NH+](CC3)CC4=CC=C(S4)Cl

InChI

InChI=1S/C19H20ClN3OS/c1-21-13-16(15-4-2-3-5-17(15)21)19(24)23-10-8-22(9-11-23)12-14-6-7-18(20)25-14/h2-7,13H,8-12H2,1H3/p+1