(4-ethyl-5-methyl-thiophen-3-yl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone

Systemtic Name: (4-ethyl-5-methyl-thiophen-3-yl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone Openeye Name: (4-ethyl-5-methyl-3-thienyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone CAS Name: (4-ethyl-5-methyl-3-thiophenyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone IUPAC Name: (4-ethyl-5-methylthiophen-3-yl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone Traditional Name: (4-ethyl-5-methyl-3-thienyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone Formula: C14H23N2OS+ MolecularWeight: 267.41022

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC=C1C(=O)N2CCC[NH+](CC2)C)C

Isomeric SMILES

CCC1=C(SC=C1C(=O)N2CCC[NH+](CC2)C)C

InChI

InChI=1S/C14H22N2OS/c1-4-12-11(2)18-10-13(12)14(17)16-7-5-6-15(3)8-9-16/h10H,4-9H2,1-3H3/p+1