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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=CS1)C(=O)N2CCC[NH+](CC2)C

Isomeric SMILES

CCCC1=CC(=CS1)C(=O)N2CCC[NH+](CC2)C

InChI

InChI=1S/C14H22N2OS/c1-3-5-13-10-12(11-18-13)14(17)16-7-4-6-15(2)8-9-16/h10-11H,3-9H2,1-2H3/p+1