[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-(4-methylthieno[2,3-b]indol-2-yl)methanone

Systemtic Name: [4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-(4-methylthieno[2,3-b]indol-2-yl)methanone Openeye Name: [4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-(4-methylthieno[2,3-b]indol-2-yl)methanone CAS Name: [4-(2-hydroxyethyl)-1-piperazin-4-iumyl]-(4-methyl-2-thieno[2,3-b]indolyl)methanone IUPAC Name: [4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-(4-methylthieno[2,3-b]indol-2-yl)methanone Traditional Name: [4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-(4-methylthien[2,3-b]indol-2-yl)methanone Formula: C18H22N3O2S+ MolecularWeight: 344.45118

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C3=C1SC(=C3)C(=O)N4CC[NH+](CC4)CCO

Isomeric SMILES

CN1C2=CC=CC=C2C3=C1SC(=C3)C(=O)N4CC[NH+](CC4)CCO

InChI

InChI=1S/C18H21N3O2S/c1-19-15-5-3-2-4-13(15)14-12-16(24-18(14)19)17(23)21-8-6-20(7-9-21)10-11-22/h2-5,12,22H,6-11H2,1H3/p+1